1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(p-tolyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methylphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-homoveratryl-3-(p-tolyl)-1-(3-pyridylmethyl)thiourea Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N(CCC2=CC(=C(C=C2)OC)OC)CC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N(CCC2=CC(=C(C=C2)OC)OC)CC3=CN=CC=C3

InChI

InChI=1S/C24H27N3O2S/c1-18-6-9-21(10-7-18)26-24(30)27(17-20-5-4-13-25-16-20)14-12-19-8-11-22(28-2)23(15-19)29-3/h4-11,13,15-16H,12,14,17H2,1-3H3,(H,26,30)