N-(5-acetamido-2-methyl-phenyl)-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(5-acetamido-2-methyl-phenyl)-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(5-acetamido-2-methyl-phenyl)-3-allyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(5-acetamido-2-methylphenyl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(5-acetamido-2-methylphenyl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(5-acetamido-2-methyl-phenyl)-3-allyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C21H20N4O3S/c1-4-9-25-20(28)16-8-6-14(10-18(16)24-21(25)29)19(27)23-17-11-15(22-13(3)26)7-5-12(17)2/h4-8,10-11H,1,9H2,2-3H3,(H,22,26)(H,23,27)(H,24,29)