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

Systemtic Name: 3-cyclohexyl-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[2-(3-methylphenyl)ethyl]thiourea Openeye Name: 3-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(m-tolyl)ethyl]thiourea CAS Name: 3-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(3-methylphenyl)ethyl]thiourea IUPAC Name: 3-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(3-methylphenyl)ethyl]thiourea Traditional Name: 3-cyclohexyl-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-1-[2-(m-tolyl)ethyl]thiourea Formula: C28H35N3O3S MolecularWeight: 493.6608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCN(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C(=S)NC4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)CCN(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C(=S)NC4CCCCC4

InChI

InChI=1S/C28H35N3O3S/c1-19-8-7-9-20(14-19)12-13-31(28(35)29-23-10-5-4-6-11-23)18-22-15-21-16-25(33-2)26(34-3)17-24(21)30-27(22)32/h7-9,14-17,23H,4-6,10-13,18H2,1-3H3,(H,29,35)(H,30,32)