4-(4-nitrophenyl)sulfonyl-N-phenethyl-piperazine-1-carbothioamide

Systemtic Name: 4-(4-nitrophenyl)sulfonyl-N-phenethyl-piperazine-1-carbothioamide Openeye Name: 4-(4-nitrophenyl)sulfonyl-N-phenethyl-piperazine-1-carbothioamide CAS Name: 4-(4-nitrophenyl)sulfonyl-N-phenethyl-1-piperazinecarbothioamide IUPAC Name: 4-(4-nitrophenyl)sulfonyl-N-phenethylpiperazine-1-carbothioamide Traditional Name: 4-nosyl-N-phenethyl-piperazine-1-carbothioamide Formula: C19H22N4O4S2 MolecularWeight: 434.53238

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=S)NCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4S2/c24-23(25)17-6-8-18(9-7-17)29(26,27)22-14-12-21(13-15-22)19(28)20-11-10-16-4-2-1-3-5-16/h1-9H,10-15H2,(H,20,28)