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

Systemtic Name: N-(2-methoxyethyl)-4-(4-nitrophenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(2-methoxyethyl)-4-(4-nitrophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-(2-methoxyethyl)-4-(4-nitrophenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(2-methoxyethyl)-4-(4-nitrophenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-(2-methoxyethyl)-4-nosyl-piperazine-1-carbothioamide Formula: C14H20N4O5S2 MolecularWeight: 388.4624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N4O5S2/c1-23-11-6-15-14(24)16-7-9-17(10-8-16)25(21,22)13-4-2-12(3-5-13)18(19)20/h2-5H,6-11H2,1H3,(H,15,24)