4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-prop-2-enylsulfanylphenyl)benzamide

Systemtic Name: 4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-prop-2-enylsulfanylphenyl)benzamide Openeye Name: N-(2-allylsulfanylphenyl)-4-(2-methyl-4-oxo-quinazolin-3-yl)benzamide CAS Name: 4-(2-methyl-4-oxo-3-quinazolinyl)-N-[2-(prop-2-enylthio)phenyl]benzamide IUPAC Name: 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(2-prop-2-enylsulfanylphenyl)benzamide Traditional Name: N-[2-(allylthio)phenyl]-4-(4-keto-2-methyl-quinazolin-3-yl)benzamide Formula: C25H21N3O2S MolecularWeight: 427.51814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4SCC=C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4SCC=C

InChI

InChI=1S/C25H21N3O2S/c1-3-16-31-23-11-7-6-10-22(23)27-24(29)18-12-14-19(15-13-18)28-17(2)26-21-9-5-4-8-20(21)25(28)30/h3-15H,1,16H2,2H3,(H,27,29)