4-[2-[5-[(4-aminophenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzenecarboximidamide

Systemtic Name: 4-[2-[5-[(4-aminophenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzenecarboximidamide Openeye Name: 4-[2-[5-[(4-aminophenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzamidine CAS Name: 4-[2-[5-[(4-aminophenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-2-benzimidazolyl]ethyl]benzenecarboximidamide IUPAC Name: 4-[2-[5-[(4-aminophenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methylbenzimidazol-2-yl]ethyl]benzenecarboximidamide Traditional Name: 4-[2-[5-[2-diethylaminoethyl(sulfanilyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzamidine Formula: C29H37N7O2S MolecularWeight: 547.71478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=CC2=C(C=C1)N(C(=N2)CCC3=CC=C(C=C3)C(=N)N)C)S(=O)(=O)C4=CC=C(C=C4)N

Isomeric SMILES

CCN(CC)CCN(C1=CC2=C(C=C1)N(C(=N2)CCC3=CC=C(C=C3)C(=N)N)C)S(=O)(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C29H37N7O2S/c1-4-35(5-2)18-19-36(39(37,38)25-14-11-23(30)12-15-25)24-13-16-27-26(20-24)33-28(34(27)3)17-8-21-6-9-22(10-7-21)29(31)32/h6-7,9-16,20H,4-5,8,17-19,30H2,1-3H3,(H3,31,32)