4-[4-oxidanylidene-2-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-3-yl]-N-phenethyl-butanamide

Systemtic Name: 4-[4-oxidanylidene-2-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-3-yl]-N-phenethyl-butanamide Openeye Name: 4-[4-oxo-2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-3-yl]-N-phenethyl-butanamide CAS Name: 4-[4-oxo-2-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-3-quinazolinyl]-N-phenethylbutanamide IUPAC Name: 4-[4-oxo-2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-3-yl]-N-phenethylbutanamide Traditional Name: 4-[4-keto-2-[(4-ketopyrido[1,2-a]pyrimidin-2-yl)methylthio]quinazolin-3-yl]-N-phenethyl-butyramide Formula: C29H27N5O3S MolecularWeight: 525.62138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CCCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)N5C=CC=CC5=N4

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CCCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)N5C=CC=CC5=N4

InChI

InChI=1S/C29H27N5O3S/c35-26(30-16-15-21-9-2-1-3-10-21)14-8-18-34-28(37)23-11-4-5-12-24(23)32-29(34)38-20-22-19-27(36)33-17-7-6-13-25(33)31-22/h1-7,9-13,17,19H,8,14-16,18,20H2,(H,30,35)