3-(3,5-dimethylphenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 3-(3,5-dimethylphenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-(3,5-dimethylphenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(4-pyridylmethyl)thiourea CAS Name: 3-(3,5-dimethylphenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-(3,5-dimethylphenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 3-(3,5-dimethylphenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(4-pyridylmethyl)thiourea Formula: C26H28N4S MolecularWeight: 428.59232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N(CCC2=C(NC3=CC=CC=C32)C)CC4=CC=NC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N(CCC2=C(NC3=CC=CC=C32)C)CC4=CC=NC=C4)C

InChI

InChI=1S/C26H28N4S/c1-18-14-19(2)16-22(15-18)29-26(31)30(17-21-8-11-27-12-9-21)13-10-23-20(3)28-25-7-5-4-6-24(23)25/h4-9,11-12,14-16,28H,10,13,17H2,1-3H3,(H,29,31)