1-cyclohexyl-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)thiourea

Systemtic Name: 1-cyclohexyl-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)thiourea Openeye Name: 1-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(m-tolyl)thiourea CAS Name: 1-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)thiourea IUPAC Name: 1-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)thiourea Traditional Name: 1-cyclohexyl-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-3-(m-tolyl)thiourea Formula: C26H31N3O3S MolecularWeight: 465.60764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C4CCCCC4

InChI

InChI=1S/C26H31N3O3S/c1-17-8-7-9-20(12-17)27-26(33)29(21-10-5-4-6-11-21)16-19-13-18-14-23(31-2)24(32-3)15-22(18)28-25(19)30/h7-9,12-15,21H,4-6,10-11,16H2,1-3H3,(H,27,33)(H,28,30)