N-[(4-methylphenyl)carbamoyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(4-methylphenyl)carbamoyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(p-tolylcarbamoyl)acetamide CAS Name: N-[(4-methylanilino)-oxomethyl]-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(4-methylphenyl)carbamoyl]-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(p-tolylcarbamoyl)acetamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C21H20N4O3S/c1-3-12-25-19(27)16-6-4-5-7-17(16)23-21(25)29-13-18(26)24-20(28)22-15-10-8-14(2)9-11-15/h3-11H,1,12-13H2,2H3,(H2,22,24,26,28)