3-chloranyl-4-methyl-N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]aniline

Systemtic Name: 3-chloranyl-4-methyl-N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]aniline Openeye Name: 3-chloro-4-methyl-N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]aniline CAS Name: 3-chloro-4-methyl-N-[(Z)-1-[4-(1-piperazin-4-iumylsulfonyl)phenyl]ethylideneamino]aniline IUPAC Name: 3-chloro-4-methyl-N-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]aniline Traditional Name: (3-chloro-4-methyl-phenyl)-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]amine Formula: C19H24ClN4O2S+ MolecularWeight: 407.93746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NN=C(C)C2=CC=C(C=C2)S(=O)(=O)N3CC[NH2+]CC3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N/N=C(/C)\C2=CC=C(C=C2)S(=O)(=O)N3CC[NH2+]CC3)Cl

InChI

InChI=1S/C19H23ClN4O2S/c1-14-3-6-17(13-19(14)20)23-22-15(2)16-4-7-18(8-5-16)27(25,26)24-11-9-21-10-12-24/h3-8,13,21,23H,9-12H2,1-2H3/p+1/b22-15-