N-[(4-nitrophenyl)carbamoyl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[(4-nitrophenyl)carbamoyl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(4-nitrophenyl)carbamoyl]acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[(4-nitroanilino)-oxomethyl]acetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(4-nitrophenyl)carbamoyl]acetamide Traditional Name: 2-(4-besylpiperazino)-N-[(4-nitrophenyl)carbamoyl]acetamide Formula: C19H21N5O6S MolecularWeight: 447.46494

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC(=O)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21N5O6S/c25-18(21-19(26)20-15-6-8-16(9-7-15)24(27)28)14-22-10-12-23(13-11-22)31(29,30)17-4-2-1-3-5-17/h1-9H,10-14H2,(H2,20,21,25,26)