4-[[1-methyl-5-(phenylsulfonylamino)indol-2-yl]methyl]benzenecarboximidamide hydrochloride

Systemtic Name: 4-[[1-methyl-5-(phenylsulfonylamino)indol-2-yl]methyl]benzenecarboximidamide hydrochloride Openeye Name: 4-[[5-(benzenesulfonamido)-1-methyl-indol-2-yl]methyl]benzamidine hydrochloride CAS Name: 4-[[5-(benzenesulfonamido)-1-methyl-2-indolyl]methyl]benzenecarboximidamide hydrochloride IUPAC Name: 4-[[5-(benzenesulfonamido)-1-methylindol-2-yl]methyl]benzenecarboximidamide hydrochloride Traditional Name: 4-[[5-(benzenesulfonamido)-1-methyl-indol-2-yl]methyl]benzamidine hydrochloride Formula: C23H23ClN4O2S MolecularWeight: 454.97232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)C=C1CC4=CC=C(C=C4)C(=N)N.Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)C=C1CC4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C23H22N4O2S.ClH/c1-27-20(13-16-7-9-17(10-8-16)23(24)25)15-18-14-19(11-12-22(18)27)26-30(28,29)21-5-3-2-4-6-21;/h2-12,14-15,26H,13H2,1H3,(H3,24,25);1H