2-[[4-(cyclopropylamino)quinazolin-2-yl]sulfanylmethyl]-8-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[4-(cyclopropylamino)quinazolin-2-yl]sulfanylmethyl]-8-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[[4-(cyclopropylamino)quinazolin-2-yl]sulfanylmethyl]-8-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[[4-(cyclopropylamino)-2-quinazolinyl]thio]methyl]-8-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[[4-(cyclopropylamino)quinazolin-2-yl]sulfanylmethyl]-8-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[[4-(cyclopropylamino)quinazolin-2-yl]thio]methyl]-8-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=CC(=O)N2C=C1)CSC3=NC4=CC=CC=C4C(=N3)NC5CC5

Isomeric SMILES

CC1=CC2=NC(=CC(=O)N2C=C1)CSC3=NC4=CC=CC=C4C(=N3)NC5CC5

InChI

InChI=1S/C21H19N5OS/c1-13-8-9-26-18(10-13)22-15(11-19(26)27)12-28-21-24-17-5-3-2-4-16(17)20(25-21)23-14-6-7-14/h2-5,8-11,14H,6-7,12H2,1H3,(H,23,24,25)