1-methyl-6-[2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonyl-pyrido[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 1-methyl-6-[2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonyl-pyrido[2,3-d]pyrimidine-2,4-dione Openeye Name: 1-methyl-6-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione CAS Name: 1-methyl-6-[[2-(1-methyl-2-pyrrolyl)-1-azepanyl]-oxomethyl]pyrido[2,3-d]pyrimidine-2,4-dione IUPAC Name: 1-methyl-6-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione Traditional Name: 1-methyl-6-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]pyrido[2,3-d]pyrimidine-2,4-quinone Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCCN2C(=O)C3=CN=C4C(=C3)C(=O)NC(=O)N4C

Isomeric SMILES

CN1C=CC=C1C2CCCCCN2C(=O)C3=CN=C4C(=C3)C(=O)NC(=O)N4C

InChI

InChI=1S/C20H23N5O3/c1-23-9-6-8-15(23)16-7-4-3-5-10-25(16)19(27)13-11-14-17(21-12-13)24(2)20(28)22-18(14)26/h6,8-9,11-12,16H,3-5,7,10H2,1-2H3,(H,22,26,28)