N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1-phenyl-benzimidazole-5-carboxamide

Systemtic Name: N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1-phenyl-benzimidazole-5-carboxamide Openeye Name: N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1-phenyl-benzimidazole-5-carboxamide CAS Name: N-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethyl]-1-phenyl-5-benzimidazolecarboxamide IUPAC Name: N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1-phenylbenzimidazole-5-carboxamide Traditional Name: N-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethyl]-1-phenyl-benzimidazole-5-carboxamide Formula: C19H18N6OS MolecularWeight: 378.45082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCNC(=O)C2=CC3=C(C=C2)N(C=N3)C4=CC=CC=C4

Isomeric SMILES

CN1C=NN=C1SCCNC(=O)C2=CC3=C(C=C2)N(C=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H18N6OS/c1-24-13-22-23-19(24)27-10-9-20-18(26)14-7-8-17-16(11-14)21-12-25(17)15-5-3-2-4-6-15/h2-8,11-13H,9-10H2,1H3,(H,20,26)