3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-prop-2-enylsulfanylphenyl)propanamide

Systemtic Name: 3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-prop-2-enylsulfanylphenyl)propanamide Openeye Name: N-(2-allylsulfanylphenyl)-3-(8-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: 3-(8-methyl-4-oxo-3-quinazolinyl)-N-[2-(prop-2-enylthio)phenyl]propanamide IUPAC Name: 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-prop-2-enylsulfanylphenyl)propanamide Traditional Name: N-[2-(allylthio)phenyl]-3-(4-keto-8-methyl-quinazolin-3-yl)propionamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=CC=CC=C3SCC=C

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=CC=CC=C3SCC=C

InChI

InChI=1S/C21H21N3O2S/c1-3-13-27-18-10-5-4-9-17(18)23-19(25)11-12-24-14-22-20-15(2)7-6-8-16(20)21(24)26/h3-10,14H,1,11-13H2,2H3,(H,23,25)