← Back

IUPAC: 4-[(9-cyclopentyl-7,7-difluoro-5-methyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methylbenzoic acid

SMILES: Cc1cc(C(=O)O)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(F)(F)C(=O)N2C

Canonical SMILES: CC1=C(C=CC(=C1)C(=O)O)NC2=NC=C3C(=N2)N(CC(C(=O)N3C)(F)F)C4CCCC4

分子式: C21H23F2N5O3

分子量: 431.40

InChIKey: APUDYQSELWZNKJ-UHFFFAOYSA-N

InChI: InChI=1S/C21H23F2N5O3/c1-12-9-13(18(29)30)7-8-15(12)25-20-24-10-16-17(26-20)28(14-5-3-4-6-14)11-21(22,23)19(31)27(16)2/h7-10,14H,3-6,11H2,1-2H3,(H,29,30)(H,24,25,26)

PubChem CID: 58015032 →

同義語

4-(9-cyclopentyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-ylamino)-3-methyl-benzoic acidSCHEMBL15605204-(9-cyclopentyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-ylamino)-3-methylbenzoic acid

拡張検索

部分構造検索→類似構造検索→