4-[2-[1-butyl-5-[phenylsulfonyl(propyl)amino]benzimidazol-2-yl]ethyl]benzenecarboximidamide

Systemtic Name: 4-[2-[1-butyl-5-[phenylsulfonyl(propyl)amino]benzimidazol-2-yl]ethyl]benzenecarboximidamide Openeye Name: 4-[2-[5-[benzenesulfonyl(propyl)amino]-1-butyl-benzimidazol-2-yl]ethyl]benzamidine CAS Name: 4-[2-[5-[benzenesulfonyl(propyl)amino]-1-butyl-2-benzimidazolyl]ethyl]benzenecarboximidamide IUPAC Name: 4-[2-[5-[benzenesulfonyl(propyl)amino]-1-butylbenzimidazol-2-yl]ethyl]benzenecarboximidamide Traditional Name: 4-[2-[5-[besyl(propyl)amino]-1-butyl-benzimidazol-2-yl]ethyl]benzamidine Formula: C29H35N5O2S MolecularWeight: 517.6855

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)N(CCC)S(=O)(=O)C3=CC=CC=C3)N=C1CCC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)N(CCC)S(=O)(=O)C3=CC=CC=C3)N=C1CCC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C29H35N5O2S/c1-3-5-20-33-27-17-16-24(34(19-4-2)37(35,36)25-9-7-6-8-10-25)21-26(27)32-28(33)18-13-22-11-14-23(15-12-22)29(30)31/h6-12,14-17,21H,3-5,13,18-20H2,1-2H3,(H3,30,31)