기본 정보
- CAS
296247-42-2- 표준 SMILES
CCOC(=O)c1c(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)sc(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)c1C- InChIKey
JWIJPKGDQGUNPG-UHFFFAOYSA-N- 분자식
- C23H16Cl2F3N3O6S
- 평균 분자량
- 590.4 g/mol
이름 및 식별자
- 우선 이름
- Ethyl 2-({4-chloro-3-nitrobenzoyl}amino)-5-{[2-chloro-5-(trifluoromethyl)anilino]carbonyl}-4-methyl-3-thiophenecarboxylate
- IUPAC
- ethyl 2-[(4-chloro-3-nitrobenzoyl)amino]-5-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]-4-methylthiophene-3-carboxylate
- 영어명
- ethyl 2-({4-chloro-3-nitrobenzoyl}amino)-5-{[2-chloro-5-(trifluoromethyl)anilino]carbonyl}-4-methyl-3-thiophenecarboxylate
- 분자식
- C23H16Cl2F3N3O6S
- 분자량
- 590.3558496
이름 및 동의어
ethyl 2-({4-chloro-3-nitrobenzoyl}amino)-5-{[2-chloro-5-(trifluoromethyl)anilino]carbonyl}-4-methyl-3-thiophenecarboxylateETHYL 2-(4-CHLORO-3-NITROBENZAMIDO)-5-{[2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL]CARBAMOYL}-4-METHYLTHIOPHENE-3-CARBOXYLATEethyl 2-(4-chloro-3-nitrobenzamido)-5-((2-chloro-5-(trifluoromethyl)phenyl)carbamoyl)-4-methylthiophene-3-carboxylateZINC08426518CBMicro_002189ChemDiv1_003920HMS598C04SMSF0012803STK008439AKOS001617967CB03701ethyl 2-[(4-chloro-3-nitrobenzoyl)amino]-5-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]-4-methylthiophene-3-carboxylate
이름 더 보기
ST052152BIM-0002117.P001AG-205/14150003SR-01000435610SR-01000435610-1296247-42-2ethyl 2-[(4-chloro-3-nitrophenyl)carbonylamino]-5-{N-[2-chloro-5-(trifluoromet hyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylateethyl 2-{[(4-chloro-3-nitrophenyl)carbonyl]amino}-5-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate
물성
구조 계산 물성
- XLogP
- 7
- 극성 표면적
- 159 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 38
- 형식 전하
- 0
- 복잡도
- 911
화학 및 산업
공급사1 곳
SPECS[email protected]
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