1-(2-cyano-4,5-dimethoxy-phenyl)-3-[4-(4-pentylcyclohexyl)phenyl]thiourea

Systemtic Name: 1-(2-cyano-4,5-dimethoxy-phenyl)-3-[4-(4-pentylcyclohexyl)phenyl]thiourea Openeye Name: 1-(2-cyano-4,5-dimethoxy-phenyl)-3-[4-(4-pentylcyclohexyl)phenyl]thiourea CAS Name: 1-(2-cyano-4,5-dimethoxyphenyl)-3-[4-(4-pentylcyclohexyl)phenyl]thiourea IUPAC Name: 1-(2-cyano-4,5-dimethoxyphenyl)-3-[4-(4-pentylcyclohexyl)phenyl]thiourea Traditional Name: 1-[4-(4-amylcyclohexyl)phenyl]-3-(2-cyano-4,5-dimethoxy-phenyl)thiourea Formula: C27H35N3O2S MolecularWeight: 465.6507

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)NC(=S)NC3=CC(=C(C=C3C#N)OC)OC

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)NC(=S)NC3=CC(=C(C=C3C#N)OC)OC

InChI

InChI=1S/C27H35N3O2S/c1-4-5-6-7-19-8-10-20(11-9-19)21-12-14-23(15-13-21)29-27(33)30-24-17-26(32-3)25(31-2)16-22(24)18-28/h12-17,19-20H,4-11H2,1-3H3,(H2,29,30,33)