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

Systemtic Name: N-(2-butoxy-5-methoxy-phenyl)-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(2-butoxy-5-methoxy-phenyl)-3-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(2-butoxy-5-methoxyphenyl)-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(2-butoxy-5-methoxyphenyl)-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(2-butoxy-5-methoxy-phenyl)-4-keto-3-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4S/c1-4-5-10-28-18-9-7-14(27-3)12-17(18)22-19(25)13-6-8-15-16(11-13)23-21(29)24(2)20(15)26/h6-9,11-12H,4-5,10H2,1-3H3,(H,22,25)(H,23,29)