4-[2-[5-[(3-bromophenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzenecarboximidamide

Systemtic Name: 4-[2-[5-[(3-bromophenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzenecarboximidamide Openeye Name: 4-[2-[5-[(3-bromophenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzamidine CAS Name: 4-[2-[5-[(3-bromophenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-2-benzimidazolyl]ethyl]benzenecarboximidamide IUPAC Name: 4-[2-[5-[(3-bromophenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methylbenzimidazol-2-yl]ethyl]benzenecarboximidamide Traditional Name: 4-[2-[5-[(3-bromophenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzamidine Formula: C29H35BrN6O2S MolecularWeight: 611.5962

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(=CC=C4)Br

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(=CC=C4)Br

InChI

InChI=1S/C29H35BrN6O2S/c1-4-35(5-2)17-18-36(39(37,38)25-8-6-7-23(30)19-25)24-14-15-27-26(20-24)33-28(34(27)3)16-11-21-9-12-22(13-10-21)29(31)32/h6-10,12-15,19-20H,4-5,11,16-18H2,1-3H3,(H3,31,32)