1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(4-methoxyphenyl)-1-(pyridin-3-ylmethylsulfanyl)urea

Systemtic Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(4-methoxyphenyl)-1-(pyridin-3-ylmethylsulfanyl)urea Openeye Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(4-methoxyphenyl)-1-(3-pyridylmethylsulfanyl)urea CAS Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(4-methoxyphenyl)-1-(3-pyridinylmethylthio)urea IUPAC Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(4-methoxyphenyl)-1-(pyridin-3-ylmethylsulfanyl)urea Traditional Name: 1-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(4-methoxyphenyl)-1-(3-pyridylmethylthio)urea Formula: C25H27N5O2S MolecularWeight: 461.57918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)CCN(C(=O)NC3=CC=C(C=C3)OC)SCC4=CN=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)CCN(C(=O)NC3=CC=C(C=C3)OC)SCC4=CN=CC=C4

InChI

InChI=1S/C25H27N5O2S/c1-17-13-22-23(14-18(17)2)29-24(28-22)10-12-30(33-16-19-5-4-11-26-15-19)25(31)27-20-6-8-21(32-3)9-7-20/h4-9,11,13-15H,10,12,16H2,1-3H3,(H,27,31)(H,28,29)