N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-[4-(4-methylpiperazino)sulfonylphenyl]-2-[(4-nitrophenyl)thio]acetamide Formula: C19H22N4O5S2 MolecularWeight: 450.53178

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5S2/c1-21-10-12-22(13-11-21)30(27,28)18-8-2-15(3-9-18)20-19(24)14-29-17-6-4-16(5-7-17)23(25)26/h2-9H,10-14H2,1H3,(H,20,24)