N-(2-dimethylaminoethyl)-4-(2-nitrophenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-(2-nitrophenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(2-dimethylaminoethyl)-4-(2-nitrophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-(2-dimethylaminoethyl)-4-(2-nitrophenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(2-nitrophenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-(2-dimethylaminoethyl)-4-(2-nitrophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C15H23N5O4S2 MolecularWeight: 401.50422

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CN(C)CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H23N5O4S2/c1-17(2)8-7-16-15(25)18-9-11-19(12-10-18)26(23,24)14-6-4-3-5-13(14)20(21)22/h3-6H,7-12H2,1-2H3,(H,16,25)