N-[[4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[[4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[[4-[2-(dimethylamino)-2-oxo-ethoxy]-3-methoxy-phenyl]methyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[[4-[2-(dimethylamino)-2-oxoethoxy]-3-methoxyphenyl]methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[[4-[2-(dimethylamino)-2-oxoethoxy]-3-methoxyphenyl]methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[4-[2-(dimethylamino)-2-keto-ethoxy]-3-methoxy-benzyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)COC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3)OC

Isomeric SMILES

CN(C)C(=O)COC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3)OC

InChI

InChI=1S/C21H22N4O5S/c1-25(2)18(26)11-30-16-7-4-12(8-17(16)29-3)10-22-19(27)13-5-6-14-15(9-13)23-21(31)24-20(14)28/h4-9H,10-11H2,1-3H3,(H,22,27)(H2,23,24,28,31)