Ethyl 6-methyl-2-thioxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
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기본 정보
- CAS
134074-42-3- 표준 SMILES
CCOC(=O)C1=C(C)NC(=S)NC1c1cc(OC)c(OC)c(OC)c1- InChIKey
ZMNDZXUVCYKSNT-UHFFFAOYSA-N- 분자식
- C17H22N2O5S
- 평균 분자량
- 366.4 g/mol
이름 및 식별자
- 우선 이름
- Ethyl 6-methyl-2-thioxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
- IUPAC
- ethyl 6-methyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate
- 영어명
- 4-methyl-2-thioxo-6-(3,4,5-trimethoxyphenyl)-3,6-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
- 분자식
- C17H22N2O5S
- 분자량
- 366.43
이름 및 동의어
134074-42-3ethyl 6-methyl-2-thioxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylateethyl 6-methyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylateMFCD010680545-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-methyl-2-thioxo-4-(3,4,5-trimethoxyphenyl)-, ethyl esterethyl 6-methyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylateethyl 4-methyl-2-sulfanyl-6-(3,4,5-trimethoxyphenyl)-1,6-dihydropyrimidine-5-carboxylateCBMicro_026981Oprea1_748849ALBB-027874STK102086STK812689
이름 더 보기
ethyl 4-methyl-2-thioxo-6-(3,4,5-trimethoxyphenyl)-3,6-dihydro-1H-pyrimidine-5-carboxylateethyl 4-methyl-2-sulfanylidene-6-(3,4,5-trimethoxyphenyl)-3,6-dihydro-1H-pyrimidine-5-carboxylate4-methyl-2-thioxo-6-(3,4,5-trimethoxyphenyl)-3,6-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
AKOS000286607AKOS000369111AKOS016060785AKOS022079673UPCMLD0ENAT5632750:001FE135098LS-09656BIM-0027042.P001
데이터베이스 식별자
- CAS
134074-42-3- Nikkaji
- J2.700.813E
물성
구조 계산 물성보충 중
- XLogP
- 1.9
- 극성 표면적
- 110 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 525
관련 반응
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