3-[[4-(3,5-dimethylpiperidin-1-yl)carbonylcyclohexyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[[4-(3,5-dimethylpiperidin-1-yl)carbonylcyclohexyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[[4-(3,5-dimethylpiperidine-1-carbonyl)cyclohexyl]methyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[[4-[(3,5-dimethyl-1-piperidinyl)-oxomethyl]cyclohexyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[[4-(3,5-dimethylpiperidine-1-carbonyl)cyclohexyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[[4-(3,5-dimethylpiperidine-1-carbonyl)cyclohexyl]methyl]-2-thioxo-1H-quinazolin-4-one Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2CCC(CC2)CN3C(=O)C4=CC=CC=C4NC3=S)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C2CCC(CC2)CN3C(=O)C4=CC=CC=C4NC3=S)C

InChI

InChI=1S/C23H31N3O2S/c1-15-11-16(2)13-25(12-15)21(27)18-9-7-17(8-10-18)14-26-22(28)19-5-3-4-6-20(19)24-23(26)29/h3-6,15-18H,7-14H2,1-2H3,(H,24,29)