1-(2-chlorophenyl)-3-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]thiourea

Systemtic Name: 1-(2-chlorophenyl)-3-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]thiourea Openeye Name: 1-(2-chlorophenyl)-3-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]thiourea CAS Name: 1-(2-chlorophenyl)-3-[2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-1-ethyl-5-benzimidazolyl]thiourea IUPAC Name: 1-(2-chlorophenyl)-3-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-ethylbenzimidazol-5-yl]thiourea Traditional Name: 1-(2-chlorophenyl)-3-[2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-1-ethyl-benzimidazol-5-yl]thiourea Formula: C23H23ClN6S2 MolecularWeight: 483.05192

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=S)NC3=CC=CC=C3Cl)N=C1CSC4=NC(=CC(=N4)C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=S)NC3=CC=CC=C3Cl)N=C1CSC4=NC(=CC(=N4)C)C

InChI

InChI=1S/C23H23ClN6S2/c1-4-30-20-10-9-16(27-22(31)29-18-8-6-5-7-17(18)24)12-19(20)28-21(30)13-32-23-25-14(2)11-15(3)26-23/h5-12H,4,13H2,1-3H3,(H2,27,29,31)