2-(4-methylphenyl)sulfonyl-5-piperazin-1-yl-aniline

Systemtic Name: 2-(4-methylphenyl)sulfonyl-5-piperazin-1-yl-aniline Openeye Name: 5-piperazin-1-yl-2-(p-tolylsulfonyl)aniline CAS Name: 2-(4-methylphenyl)sulfonyl-5-(1-piperazinyl)aniline IUPAC Name: 2-(4-methylphenyl)sulfonyl-5-piperazin-1-ylaniline Traditional Name: (5-piperazino-2-tosyl-phenyl)amine Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)N3CCNCC3)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)N3CCNCC3)N

InChI

InChI=1S/C17H21N3O2S/c1-13-2-5-15(6-3-13)23(21,22)17-7-4-14(12-16(17)18)20-10-8-19-9-11-20/h2-7,12,19H,8-11,18H2,1H3