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

Systemtic Name: 1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-(3-methylphenyl)-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-(m-tolyl)-1-(2-pyridylmethyl)thiourea CAS Name: 1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-(3-methylphenyl)-1-(2-pyridinylmethyl)thiourea IUPAC Name: 1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-(3-methylphenyl)-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-(m-tolyl)-1-(2-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=C2C=C(C=C3)C)C)CC4=CC=CC=N4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N(CCC2=C(NC3=C2C=C(C=C3)C)C)CC4=CC=CC=N4

InChI

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