4-[[1-methyl-5-[[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-quinolin-8-ylsulfonyl-amino]benzimidazol-2-yl]methyl]benzenecarboximidamide

Systemtic Name: 4-[[1-methyl-5-[[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-quinolin-8-ylsulfonyl-amino]benzimidazol-2-yl]methyl]benzenecarboximidamide Openeye Name: 4-[[1-methyl-5-[[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-(8-quinolylsulfonyl)amino]benzimidazol-2-yl]methyl]benzamidine CAS Name: 4-[[1-methyl-5-[[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-(8-quinolinylsulfonyl)amino]-2-benzimidazolyl]methyl]benzenecarboximidamide IUPAC Name: 4-[[1-methyl-5-[[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-quinolin-8-ylsulfonylamino]benzimidazol-2-yl]methyl]benzenecarboximidamide Traditional Name: 4-[[5-[[2-keto-2-(4-methylpiperazino)ethyl]-(8-quinolylsulfonyl)amino]-1-methyl-benzimidazol-2-yl]methyl]benzamidine Formula: C32H34N8O3S MolecularWeight: 610.72916

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CN(C2=CC3=C(C=C2)N(C(=N3)CC4=CC=C(C=C4)C(=N)N)C)S(=O)(=O)C5=CC=CC6=C5N=CC=C6

Isomeric SMILES

CN1CCN(CC1)C(=O)CN(C2=CC3=C(C=C2)N(C(=N3)CC4=CC=C(C=C4)C(=N)N)C)S(=O)(=O)C5=CC=CC6=C5N=CC=C6

InChI

InChI=1S/C32H34N8O3S/c1-37-15-17-39(18-16-37)30(41)21-40(44(42,43)28-7-3-5-23-6-4-14-35-31(23)28)25-12-13-27-26(20-25)36-29(38(27)2)19-22-8-10-24(11-9-22)32(33)34/h3-14,20H,15-19,21H2,1-2H3,(H3,33,34)