4-(2-nitrophenyl)sulfonyl-N-prop-2-enyl-piperazine-1-carbothioamide

Systemtic Name: 4-(2-nitrophenyl)sulfonyl-N-prop-2-enyl-piperazine-1-carbothioamide Openeye Name: N-allyl-4-(2-nitrophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: 4-(2-nitrophenyl)sulfonyl-N-prop-2-enyl-1-piperazinecarbothioamide IUPAC Name: 4-(2-nitrophenyl)sulfonyl-N-prop-2-enylpiperazine-1-carbothioamide Traditional Name: N-allyl-4-(2-nitrophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C14H18N4O4S2 MolecularWeight: 370.44712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O4S2/c1-2-7-15-14(23)16-8-10-17(11-9-16)24(21,22)13-6-4-3-5-12(13)18(19)20/h2-6H,1,7-11H2,(H,15,23)