기본 정보
- CAS
339278-18-1- 표준 SMILES
Cn1c(C(=O)NCc2cccs2)cnc1Sc1ncc(C(F)(F)F)cc1Cl- InChIKey
KKZWKHNAFGRURF-UHFFFAOYSA-N- 분자식
- C16H12ClF3N4OS2
- 평균 분자량
- 432.9 g/mol
이름 및 식별자
- 우선 이름
- 2-((3-Chloro-5-(trifluoromethyl)-2-pyridinyl)sulfanyl)-1-methyl-N-(thiophen-2-ylmethyl)-1H-imidazole-5-carboxamide
- IUPAC
- 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-3-methyl-N-(thiophen-2-ylmethyl)imidazole-4-carboxamide
- 영어명
- 2-([3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl)-1-methyl-N-(2-thienylmethyl)-1H-imidazole-5-carboxamide
- 분자식
- C16H12ClF3N4OS2
- 분자량
- 432.87
이름 및 동의어
339278-18-12-((3-Chloro-5-(trifluoromethyl)-2-pyridinyl)sulfanyl)-1-methyl-N-(thiophen-2-ylmethyl)-1H-imidazole-5-carboxamide2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-3-methyl-N-(thiophen-2-ylmethyl)imidazole-4-carboxamide2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}-1-methyl-N-[(thiophen-2-yl)methyl]-1H-imidazole-5-carboxamideAKOS0050902984L-0082-((3-Chloro-5-(trifluoromethyl)pyridin-2-yl)thio)-1-methyl-N-(thiophen-2-ylmethyl)-1H-imidazole-5-carboxamide1H-Imidazole-5-carboxamide, 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]-1-methyl-N-(2-thienylmethyl)-2-([3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl)-1-methyl-N-(2-thienylmethyl)-1H-imidazole-5-carboxamide
데이터베이스 식별자
- CAS
339278-18-1
물성
구조 계산 물성
- XLogP
- 4
- 극성 표면적
- 113 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 27
- 형식 전하
- 0
- 복잡도
- 530
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