3-(2,4-dimethoxyphenyl)-N-(2,3-dimethylcyclohexyl)-4-oxidanylidene-2-sulfanylidene-4aH-quinazoline-7-carboxamide

Systemtic Name: 3-(2,4-dimethoxyphenyl)-N-(2,3-dimethylcyclohexyl)-4-oxidanylidene-2-sulfanylidene-4aH-quinazoline-7-carboxamide Openeye Name: 3-(2,4-dimethoxyphenyl)-N-(2,3-dimethylcyclohexyl)-4-oxo-2-thioxo-4aH-quinazoline-7-carboxamide CAS Name: 3-(2,4-dimethoxyphenyl)-N-(2,3-dimethylcyclohexyl)-4-oxo-2-sulfanylidene-4aH-quinazoline-7-carboxamide IUPAC Name: 3-(2,4-dimethoxyphenyl)-N-(2,3-dimethylcyclohexyl)-4-oxo-2-sulfanylidene-4aH-quinazoline-7-carboxamide Traditional Name: 3-(2,4-dimethoxyphenyl)-N-(2,3-dimethylcyclohexyl)-4-keto-2-thioxo-4aH-quinazoline-7-carboxamide Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2=CC3=NC(=S)N(C(=O)C3C=C2)C4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2=CC3=NC(=S)N(C(=O)C3C=C2)C4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C25H29N3O4S/c1-14-6-5-7-19(15(14)2)26-23(29)16-8-10-18-20(12-16)27-25(33)28(24(18)30)21-11-9-17(31-3)13-22(21)32-4/h8-15,18-19H,5-7H2,1-4H3,(H,26,29)