1-[2-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-pyridin-4-yl]sulfanylethyl]-3-phenyl-urea

Systemtic Name: 1-[2-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-pyridin-4-yl]sulfanylethyl]-3-phenyl-urea Openeye Name: 1-[2-[[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-4-pyridyl]sulfanyl]ethyl]-3-phenyl-urea CAS Name: 1-[2-[[2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridinyl]thio]ethyl]-3-phenylurea IUPAC Name: 1-[2-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methylpyridin-4-yl]sulfanylethyl]-3-phenylurea Traditional Name: 1-[2-[[2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridyl]thio]ethyl]-3-phenyl-urea Formula: C23H23N5OS2 MolecularWeight: 449.59162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)SCCNC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)SCCNC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H23N5OS2/c1-16-20(15-31-23-27-18-9-5-6-10-19(18)28-23)24-12-11-21(16)30-14-13-25-22(29)26-17-7-3-2-4-8-17/h2-12H,13-15H2,1H3,(H,27,28)(H2,25,26,29)