2-[3-[(3,4-dimethoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methylcyclohexyl)ethanamide

Systemtic Name: 2-[3-[(3,4-dimethoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methylcyclohexyl)ethanamide Openeye Name: 2-[3-[(3,4-dimethoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-methylcyclohexyl)acetamide CAS Name: 2-[[3-[(3,4-dimethoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]-N-(2-methylcyclohexyl)acetamide IUPAC Name: 2-[3-[(3,4-dimethoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-(2-methylcyclohexyl)acetamide Traditional Name: 2-[(4-keto-3-veratryl-quinazolin-2-yl)thio]-N-(2-methylcyclohexyl)acetamide Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1CCCCC1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H31N3O4S/c1-17-8-4-6-10-20(17)27-24(30)16-34-26-28-21-11-7-5-9-19(21)25(31)29(26)15-18-12-13-22(32-2)23(14-18)33-3/h5,7,9,11-14,17,20H,4,6,8,10,15-16H2,1-3H3,(H,27,30)