1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-cyclohexyl-3-homoveratryl-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]thiourea Formula: C29H37N3O3S MolecularWeight: 507.68738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(C3CCCCC3)C(=S)NCCC4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(C3CCCCC3)C(=S)NCCC4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C29H37N3O3S/c1-19-14-20(2)24-17-22(28(33)31-25(24)15-19)18-32(23-8-6-5-7-9-23)29(36)30-13-12-21-10-11-26(34-3)27(16-21)35-4/h10-11,14-17,23H,5-9,12-13,18H2,1-4H3,(H,30,36)(H,31,33)