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

Systemtic Name: 1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-cyclohexyl-3-homoveratryl-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C28H35N3O3S MolecularWeight: 493.6608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(C3CCCCC3)C(=S)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(C3CCCCC3)C(=S)NCCC4=CC(=C(C=C4)OC)OC

InChI

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