3-(3,4-dimethoxyphenyl)-7-(4-methylpiperazin-1-yl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-7-(4-methylpiperazin-1-yl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(3,4-dimethoxyphenyl)-7-(4-methylpiperazine-1-carbonyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-(3,4-dimethoxyphenyl)-7-[(4-methyl-1-piperazinyl)-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(3,4-dimethoxyphenyl)-7-(4-methylpiperazine-1-carbonyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(3,4-dimethoxyphenyl)-7-(4-methylpiperazine-1-carbonyl)-2-thioxo-1H-quinazolin-4-one Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C22H24N4O4S/c1-24-8-10-25(11-9-24)20(27)14-4-6-16-17(12-14)23-22(31)26(21(16)28)15-5-7-18(29-2)19(13-15)30-3/h4-7,12-13H,8-11H2,1-3H3,(H,23,31)