3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)-N-[2-(phenylmethylsulfanyl)phenyl]propanamide

Systemtic Name: 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)-N-[2-(phenylmethylsulfanyl)phenyl]propanamide Openeye Name: N-(2-benzylsulfanylphenyl)-3-(3-methyl-4-oxo-quinazolin-2-yl)propanamide CAS Name: 3-(3-methyl-4-oxo-2-quinazolinyl)-N-[2-(phenylmethylthio)phenyl]propanamide IUPAC Name: N-(2-benzylsulfanylphenyl)-3-(3-methyl-4-oxoquinazolin-2-yl)propanamide Traditional Name: N-[2-(benzylthio)phenyl]-3-(4-keto-3-methyl-quinazolin-2-yl)propionamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)NC3=CC=CC=C3SCC4=CC=CC=C4

Isomeric SMILES

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)NC3=CC=CC=C3SCC4=CC=CC=C4

InChI

InChI=1S/C25H23N3O2S/c1-28-23(26-20-12-6-5-11-19(20)25(28)30)15-16-24(29)27-21-13-7-8-14-22(21)31-17-18-9-3-2-4-10-18/h2-14H,15-17H2,1H3,(H,27,29)