1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(3-methylphenyl)sulfanyl-1-(pyridin-3-ylmethyl)urea

Systemtic Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(3-methylphenyl)sulfanyl-1-(pyridin-3-ylmethyl)urea Openeye Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(m-tolylsulfanyl)-1-(3-pyridylmethyl)urea CAS Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-[(3-methylphenyl)thio]-1-(3-pyridinylmethyl)urea IUPAC Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(3-methylphenyl)sulfanyl-1-(pyridin-3-ylmethyl)urea Traditional Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(m-tolylthio)-1-(3-pyridylmethyl)urea Formula: C25H27N5OS MolecularWeight: 445.57978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SNC(=O)N(CCC2=NC3=C(N2)C=C(C(=C3)C)C)CC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)SNC(=O)N(CCC2=NC3=C(N2)C=C(C(=C3)C)C)CC4=CN=CC=C4

InChI

InChI=1S/C25H27N5OS/c1-17-6-4-8-21(12-17)32-29-25(31)30(16-20-7-5-10-26-15-20)11-9-24-27-22-13-18(2)19(3)14-23(22)28-24/h4-8,10,12-15H,9,11,16H2,1-3H3,(H,27,28)(H,29,31)