N-butylsulfonyl-2-methyl-7-(phenylmethyl)-3-pyridin-2-yl-benzimidazole-5-carboxamide

Systemtic Name: N-butylsulfonyl-2-methyl-7-(phenylmethyl)-3-pyridin-2-yl-benzimidazole-5-carboxamide Openeye Name: 7-benzyl-N-butylsulfonyl-2-methyl-3-(2-pyridyl)benzimidazole-5-carboxamide CAS Name: N-butylsulfonyl-2-methyl-7-(phenylmethyl)-3-(2-pyridinyl)-5-benzimidazolecarboxamide IUPAC Name: 7-benzyl-N-butylsulfonyl-2-methyl-3-pyridin-2-ylbenzimidazole-5-carboxamide Traditional Name: 7-benzyl-N-butylsulfonyl-2-methyl-3-(2-pyridyl)benzimidazole-5-carboxamide Formula: C25H26N4O3S MolecularWeight: 462.56394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(=O)C1=CC(=C2C(=C1)N(C(=N2)C)C3=CC=CC=N3)CC4=CC=CC=C4

Isomeric SMILES

CCCCS(=O)(=O)NC(=O)C1=CC(=C2C(=C1)N(C(=N2)C)C3=CC=CC=N3)CC4=CC=CC=C4

InChI

InChI=1S/C25H26N4O3S/c1-3-4-14-33(31,32)28-25(30)21-16-20(15-19-10-6-5-7-11-19)24-22(17-21)29(18(2)27-24)23-12-8-9-13-26-23/h5-13,16-17H,3-4,14-15H2,1-2H3,(H,28,30)