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

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-3-allyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-3-allyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C21H20N4O4S/c1-4-9-25-20(28)15-7-5-13(10-16(15)24-21(25)30)19(27)23-17-11-14(22-12(2)26)6-8-18(17)29-3/h4-8,10-11H,1,9H2,2-3H3,(H,22,26)(H,23,27)(H,24,30)