2-[4-[[4-[(1-ethyl-2-oxidanylidene-3H-benzimidazol-5-yl)carbamoylamino]phenyl]methyl]piperazin-1-yl]ethanesulfonic acid

Systemtic Name: 2-[4-[[4-[(1-ethyl-2-oxidanylidene-3H-benzimidazol-5-yl)carbamoylamino]phenyl]methyl]piperazin-1-yl]ethanesulfonic acid Openeye Name: 2-[4-[[4-[(1-ethyl-2-oxo-3H-benzimidazol-5-yl)carbamoylamino]phenyl]methyl]piperazin-1-yl]ethanesulfonic acid CAS Name: 2-[4-[[4-[[[(1-ethyl-2-oxo-3H-benzimidazol-5-yl)amino]-oxomethyl]amino]phenyl]methyl]-1-piperazinyl]ethanesulfonic acid IUPAC Name: 2-[4-[[4-[(1-ethyl-2-oxo-3H-benzimidazol-5-yl)carbamoylamino]phenyl]methyl]piperazin-1-yl]ethanesulfonic acid Traditional Name: 2-[4-[4-[(1-ethyl-2-keto-3H-benzimidazol-5-yl)carbamoylamino]benzyl]piperazino]ethanesulfonic acid Formula: C23H30N6O5S MolecularWeight: 502.5865

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)NC3=CC=C(C=C3)CN4CCN(CC4)CCS(=O)(=O)O)NC1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)NC3=CC=C(C=C3)CN4CCN(CC4)CCS(=O)(=O)O)NC1=O

InChI

InChI=1S/C23H30N6O5S/c1-2-29-21-8-7-19(15-20(21)26-23(29)31)25-22(30)24-18-5-3-17(4-6-18)16-28-11-9-27(10-12-28)13-14-35(32,33)34/h3-8,15H,2,9-14,16H2,1H3,(H,26,31)(H2,24,25,30)(H,32,33,34)