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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N(CCC2=C(NC3=CC=CC=C32)C)CC4=CC=CC=N4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N(CCC2=C(NC3=CC=CC=C32)C)CC4=CC=CC=N4)C

InChI

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