N-cyclopropyl-4-(3-nitrophenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-cyclopropyl-4-(3-nitrophenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-cyclopropyl-4-(3-nitrophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-cyclopropyl-4-(3-nitrophenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-cyclopropyl-4-(3-nitrophenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-cyclopropyl-4-(3-nitrophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C14H18N4O4S2 MolecularWeight: 370.44712

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O4S2/c19-18(20)12-2-1-3-13(10-12)24(21,22)17-8-6-16(7-9-17)14(23)15-11-4-5-11/h1-3,10-11H,4-9H2,(H,15,23)