4-(9-cyclopentyl-6,7,8,9-tetrahydro-5,7,7-trimethyl-6-oxo-5H-pyrimido[4,5-b][1,4]diazepin-2-ylthio)-benzoic acid

HCID 57940523

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CN1C(=O)C(C)(C)CN(C2CCCC2)c2nc(Sc3ccc(C(=O)O)cc3)ncc21
InChIKey: IAESHQLORVVSTM-UHFFFAOYSA-N
분자식: C22H26N4O3S
평균 분자량: 426.5 g/mol

이름 및 식별자

우선 이름: 4-(9-cyclopentyl-6,7,8,9-tetrahydro-5,7,7-trimethyl-6-oxo-5H-pyrimido[4,5-b][1,4]diazepin-2-ylthio)-benzoic acid
IUPAC: 4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)sulfanyl]benzoic acid

이름 및 동의어

SCHEMBL2398288IAESHQLORVVSTM-UHFFFAOYSA-N4-(9-cyclopentyl-6,7,8,9-tetrahydro-5,7,7-trimethyl-6-oxo-5H-pyrimido[4,5-b][1,4]diazepin-2-ylthio)-benzoic acid