N-[6,7-dimethoxy-4-oxidanylidene-2-(thiophen-2-ylmethyl)quinazolin-3-yl]cyclobutanecarboxamide

Systemtic Name: N-[6,7-dimethoxy-4-oxidanylidene-2-(thiophen-2-ylmethyl)quinazolin-3-yl]cyclobutanecarboxamide Openeye Name: N-[6,7-dimethoxy-4-oxo-2-(2-thienylmethyl)quinazolin-3-yl]cyclobutanecarboxamide CAS Name: N-[6,7-dimethoxy-4-oxo-2-(thiophen-2-ylmethyl)-3-quinazolinyl]cyclobutanecarboxamide IUPAC Name: N-[6,7-dimethoxy-4-oxo-2-(thiophen-2-ylmethyl)quinazolin-3-yl]cyclobutanecarboxamide Traditional Name: N-[4-keto-6,7-dimethoxy-2-(2-thenyl)quinazolin-3-yl]cyclobutanecarboxamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=N2)CC3=CC=CS3)NC(=O)C4CCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=N2)CC3=CC=CS3)NC(=O)C4CCC4)OC

InChI

InChI=1S/C20H21N3O4S/c1-26-16-10-14-15(11-17(16)27-2)21-18(9-13-7-4-8-28-13)23(20(14)25)22-19(24)12-5-3-6-12/h4,7-8,10-12H,3,5-6,9H2,1-2H3,(H,22,24)