N-[(4-acetamidophenyl)methyl]-3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[(4-acetamidophenyl)methyl]-3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[(4-acetamidophenyl)methyl]-3-ethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[(4-acetamidophenyl)methyl]-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[(4-acetamidophenyl)methyl]-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(4-acetamidobenzyl)-3-ethyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)NC(=O)C)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)NC(=O)C)NC1=S

InChI

InChI=1S/C20H20N4O3S/c1-3-24-19(27)16-9-6-14(10-17(16)23-20(24)28)18(26)21-11-13-4-7-15(8-5-13)22-12(2)25/h4-10H,3,11H2,1-2H3,(H,21,26)(H,22,25)(H,23,28)