4-(3-nitrophenyl)sulfonyl-N-(2-phenylsulfanylethyl)piperazine-1-carboxamide

Systemtic Name: 4-(3-nitrophenyl)sulfonyl-N-(2-phenylsulfanylethyl)piperazine-1-carboxamide Openeye Name: 4-(3-nitrophenyl)sulfonyl-N-(2-phenylsulfanylethyl)piperazine-1-carboxamide CAS Name: 4-(3-nitrophenyl)sulfonyl-N-[2-(phenylthio)ethyl]-1-piperazinecarboxamide IUPAC Name: 4-(3-nitrophenyl)sulfonyl-N-(2-phenylsulfanylethyl)piperazine-1-carboxamide Traditional Name: 4-(3-nitrophenyl)sulfonyl-N-[2-(phenylthio)ethyl]piperazine-1-carboxamide Formula: C19H22N4O5S2 MolecularWeight: 450.53178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCCSC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)NCCSC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5S2/c24-19(20-9-14-29-17-6-2-1-3-7-17)21-10-12-22(13-11-21)30(27,28)18-8-4-5-16(15-18)23(25)26/h1-8,15H,9-14H2,(H,20,24)