N-[(4-methylphenyl)carbamoyl]-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-[(4-methylphenyl)carbamoyl]-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: 2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-N-(p-tolylcarbamoyl)acetamide CAS Name: N-[(4-methylanilino)-oxomethyl]-2-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-[(4-methylphenyl)carbamoyl]-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: 2-[4-(2-nitrophenyl)sulfonylpiperazino]-N-(p-tolylcarbamoyl)acetamide Formula: C20H23N5O6S MolecularWeight: 461.49152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O6S/c1-15-6-8-16(9-7-15)21-20(27)22-19(26)14-23-10-12-24(13-11-23)32(30,31)18-5-3-2-4-17(18)25(28)29/h2-9H,10-14H2,1H3,(H2,21,22,26,27)