기본 정보
- 표준 SMILES
CSC(=C[N+](=O)[O-])NCCSCc1nc[nH]c1C- InChIKey
MVCKONDSKZNVRK-UHFFFAOYSA-N- 분자식
- C10H16N4O2S2
- 평균 분자량
- 288.4 g/mol
이름 및 식별자
- 우선 이름
- 1-nitro-2-methylthio-2-{2-[(4-methyl-1H-imidazol-5-yl)methylthio]ethylamino}ethylene
- IUPAC
- N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-1-methylsulfanyl-2-nitroethenamine
이름 및 동의어
SCHEMBL10857133SCHEMBL11233476MVCKONDSKZNVRK-UHFFFAOYSA-N1-nitro-2-methylthio-2-[2-((4-methyl-5-imidazolyl)-methylthio)ethylamino]ethylene1-nitro-2-methylthio-2-[2-((4-methyl-5-imidazolyl)methylthio)ethylamino]-ethylene1-nitro-2-methylthio-2-[2-((4-methyl-5-imidazolyl)methylthio)ethylamino]ethylene1-nitro-2-methylthio-2-[2-((4-methyl-5-immidazolyl)-methylthio)ethylamino]ethylene1-Nitro-2-methylthio-2-[2-((5-methyl-4-imidazolyl)methylthio) ethylamino]ethylene1-Nitro-2-methylthio-2-[2-((5-methyl-4-imidazolyl)methylthio)ethylamino]ethylene1-nitro-2-methylthio-2-{2-[(4-methyl-1H-imidazol-5-yl)methylthio]ethylamino}ethylene
데이터베이스 식별자
- PubChem CID
- 70456864
물성
구조 계산 물성
- XLogP
- 1.8
- 극성 표면적
- 137 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 296
관련 반응
11건
화합물 노트
불러오는 중…