N-(2-butoxy-5-methoxy-phenyl)-3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(2-butoxy-5-methoxy-phenyl)-3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(2-butoxy-5-methoxy-phenyl)-3-ethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(2-butoxy-5-methoxyphenyl)-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(2-butoxy-5-methoxyphenyl)-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(2-butoxy-5-methoxy-phenyl)-3-ethyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)OC)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)OC)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC

InChI

InChI=1S/C22H25N3O4S/c1-4-6-11-29-19-10-8-15(28-3)13-18(19)23-20(26)14-7-9-16-17(12-14)24-22(30)25(5-2)21(16)27/h7-10,12-13H,4-6,11H2,1-3H3,(H,23,26)(H,24,30)