3-[2-[(7-chloranyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]-N-phenethyl-propanamide

Systemtic Name: 3-[2-[(7-chloranyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]-N-phenethyl-propanamide Openeye Name: 3-[2-[(7-chloro-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-4-oxo-quinazolin-3-yl]-N-phenethyl-propanamide CAS Name: 3-[2-[(7-chloro-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-4-oxo-3-quinazolinyl]-N-phenethylpropanamide IUPAC Name: 3-[2-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-4-oxoquinazolin-3-yl]-N-phenethylpropanamide Traditional Name: 3-[2-[(7-chloro-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methylthio]-4-keto-quinazolin-3-yl]-N-phenethyl-propionamide Formula: C28H24ClN5O3S MolecularWeight: 546.03986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)N5C=C(C=CC5=N4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)N5C=C(C=CC5=N4)Cl

InChI

InChI=1S/C28H24ClN5O3S/c29-20-10-11-24-31-21(16-26(36)34(24)17-20)18-38-28-32-23-9-5-4-8-22(23)27(37)33(28)15-13-25(35)30-14-12-19-6-2-1-3-7-19/h1-11,16-17H,12-15,18H2,(H,30,35)