N5-(phenylmethyl)-3-propan-2-ylsulfonyl-benzimidazole-2,5-diamine

Systemtic Name: N5-(phenylmethyl)-3-propan-2-ylsulfonyl-benzimidazole-2,5-diamine Openeye Name: N5-benzyl-3-isopropylsulfonyl-benzimidazole-2,5-diamine CAS Name: N5-(phenylmethyl)-3-propan-2-ylsulfonylbenzimidazole-2,5-diamine IUPAC Name: 5-N-benzyl-3-propan-2-ylsulfonylbenzimidazole-2,5-diamine Traditional Name: (2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-benzyl-amine Formula: C17H20N4O2S MolecularWeight: 344.4313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)NCC3=CC=CC=C3)N=C1N

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)NCC3=CC=CC=C3)N=C1N

InChI

InChI=1S/C17H20N4O2S/c1-12(2)24(22,23)21-16-10-14(8-9-15(16)20-17(21)18)19-11-13-6-4-3-5-7-13/h3-10,12,19H,11H2,1-2H3,(H2,18,20)