2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-[(4-nitrophenyl)carbamoyl]ethanamide

Systemtic Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-[(4-nitrophenyl)carbamoyl]ethanamide Openeye Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-[(4-nitrophenyl)carbamoyl]acetamide CAS Name: 2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-N-[(4-nitroanilino)-oxomethyl]acetamide IUPAC Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-[(4-nitrophenyl)carbamoyl]acetamide Traditional Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-N-[(4-nitrophenyl)carbamoyl]acetamide Formula: C21H25N5O6S MolecularWeight: 475.5181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H25N5O6S/c1-15-3-8-19(13-16(15)2)33(31,32)25-11-9-24(10-12-25)14-20(27)23-21(28)22-17-4-6-18(7-5-17)26(29)30/h3-8,13H,9-12,14H2,1-2H3,(H2,22,23,27,28)