N-(2-cyanoethyl)-4-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-4-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-4-[4-(4-methylpiperazin-1-yl)sulfonylpiperazine-1-carbonyl]benzenesulfonamide CAS Name: N-(2-cyanoethyl)-4-[[4-[(4-methyl-1-piperazinyl)sulfonyl]-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-4-[4-(4-methylpiperazin-1-yl)sulfonylpiperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-(2-cyanoethyl)-4-[4-(4-methylpiperazino)sulfonylpiperazine-1-carbonyl]benzenesulfonamide Formula: C19H28N6O5S2 MolecularWeight: 484.59282

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N

InChI

InChI=1S/C19H28N6O5S2/c1-22-9-13-24(14-10-22)32(29,30)25-15-11-23(12-16-25)19(26)17-3-5-18(6-4-17)31(27,28)21-8-2-7-20/h3-6,21H,2,8-16H2,1H3