1-cyclohexyl-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2,4-dimethoxyphenyl)thiourea

Systemtic Name: 1-cyclohexyl-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2,4-dimethoxyphenyl)thiourea Openeye Name: 1-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethoxyphenyl)thiourea CAS Name: 1-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethoxyphenyl)thiourea IUPAC Name: 1-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethoxyphenyl)thiourea Traditional Name: 1-cyclohexyl-3-(2,4-dimethoxyphenyl)-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C27H33N3O5S MolecularWeight: 511.63302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=S)N(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C4CCCCC4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=S)N(CC2=CC3=CC(=C(C=C3NC2=O)OC)OC)C4CCCCC4)OC

InChI

InChI=1S/C27H33N3O5S/c1-32-20-10-11-21(23(14-20)33-2)29-27(36)30(19-8-6-5-7-9-19)16-18-12-17-13-24(34-3)25(35-4)15-22(17)28-26(18)31/h10-15,19H,5-9,16H2,1-4H3,(H,28,31)(H,29,36)