N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]-1H-benzimidazol-2-amine

Systemtic Name: N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]-1H-benzimidazol-2-amine Openeye Name: N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]-1H-benzimidazol-2-amine CAS Name: N-[(Z)-1-[4-(1-piperazin-4-iumylsulfonyl)phenyl]ethylideneamino]-1H-benzimidazol-2-amine IUPAC Name: N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]-1H-benzimidazol-2-amine Traditional Name: 1H-benzimidazol-2-yl-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]amine Formula: C19H23N6O2S+ MolecularWeight: 399.48992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC2=CC=CC=C2N1)C3=CC=C(C=C3)S(=O)(=O)N4CC[NH2+]CC4

Isomeric SMILES

C/C(=N/NC1=NC2=CC=CC=C2N1)/C3=CC=C(C=C3)S(=O)(=O)N4CC[NH2+]CC4

InChI

InChI=1S/C19H22N6O2S/c1-14(23-24-19-21-17-4-2-3-5-18(17)22-19)15-6-8-16(9-7-15)28(26,27)25-12-10-20-11-13-25/h2-9,20H,10-13H2,1H3,(H2,21,22,24)/p+1/b23-14-