N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]pyridine-2-carboxamide

Systemtic Name: N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]pyridine-2-carboxamide Openeye Name: N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]pyridine-2-carboxamide CAS Name: N-[(Z)-1-[4-(1-piperazin-4-iumylsulfonyl)phenyl]ethylideneamino]-2-pyridinecarboxamide IUPAC Name: N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]pyridine-2-carboxamide Traditional Name: N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]picolinamide Formula: C18H22N5O3S+ MolecularWeight: 388.46398

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=CC=N1)C2=CC=C(C=C2)S(=O)(=O)N3CC[NH2+]CC3

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=CC=N1)/C2=CC=C(C=C2)S(=O)(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C18H21N5O3S/c1-14(21-22-18(24)17-4-2-3-9-20-17)15-5-7-16(8-6-15)27(25,26)23-12-10-19-11-13-23/h2-9,19H,10-13H2,1H3,(H,22,24)/p+1/b21-14-