3-cyclohexyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 3-cyclohexyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-cyclohexyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-cyclohexyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-cyclohexyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-cyclohexyl-1-homoveratryl-1-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]thiourea Formula: C29H37N3O3S MolecularWeight: 507.68738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCC3=CC(=C(C=C3)OC)OC)C(=S)NC4CCCCC4

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCC3=CC(=C(C=C3)OC)OC)C(=S)NC4CCCCC4

InChI

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