기본 정보
- CAS
956371-10-1- 표준 SMILES
C=CCn1c(Sc2ncc(C(F)(F)F)cc2Cl)nnc1-c1csc(-n2nc(C)cc2C(F)(F)F)n1- InChIKey
GJFJVCQZKKFCQG-UHFFFAOYSA-N- 분자식
- C19H12ClF6N7S2
- 평균 분자량
- 551.9 g/mol
이름 및 식별자
- 우선 이름
- 4-allyl-5-{2-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}-4H-1,2,4-triazol-3-yl 3-chloro-5-(trifluoromethyl)-2-pyridinyl sulfide
- IUPAC
- 4-[5-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazole
- 영어명
- 4-Allyl-5-(2-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl)-4H-1,2,4-triazol-3-yl 3-chloro-5-(trifluoromethyl)-2-pyridinyl sulfide
- 분자식
- C19H12ClF6N7S2
- 분자량
- 551.92
이름 및 동의어
956371-10-14-allyl-5-{2-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}-4H-1,2,4-triazol-3-yl 3-chloro-5-(trifluoromethyl)-2-pyridinyl sulfide3-chloro-2-[(5-{2-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine4-[5-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazoleAKOS0050968325W-08784-(4-Allyl-5-((3-chloro-5-(trifluoromethyl)pyridin-2-yl)thio)-4H-1,2,4-triazol-3-yl)-2-(3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl)thiazole4-Allyl-5-(2-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl)-4H-1,2,4-triazol-3-yl 3-chloro-5-(trifluoromethyl)-2-pyridinyl sulfidePyridine, 3-chloro-2-[[5-[2-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-4-thiazolyl]-4-(2-propen-1-yl)-4H-1,2,4-triazol-3-yl]thio]-5-(trifluoromethyl)-
데이터베이스 식별자
물성
구조 계산 물성
- XLogP
- 5.7
- 극성 표면적
- 128 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 13
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 35
- 형식 전하
- 0
- 복잡도
- 749
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