N-(3-chlorophenyl)-3-nitro-4-[(2E)-2-(thiolan-3-ylidene)hydrazinyl]benzenesulfonamide

Systemtic Name: N-(3-chlorophenyl)-3-nitro-4-[(2E)-2-(thiolan-3-ylidene)hydrazinyl]benzenesulfonamide Openeye Name: N-(3-chlorophenyl)-3-nitro-4-[(2E)-2-tetrahydrothiophen-3-ylidenehydrazino]benzenesulfonamide CAS Name: N-(3-chlorophenyl)-3-nitro-4-[(2E)-2-(3-thiolanylidene)hydrazinyl]benzenesulfonamide IUPAC Name: N-(3-chlorophenyl)-3-nitro-4-[(2E)-2-(thiolan-3-ylidene)hydrazinyl]benzenesulfonamide Traditional Name: N-(3-chlorophenyl)-3-nitro-4-[(N'E)-N'-tetrahydrothiophen-3-ylidenehydrazino]benzenesulfonamide Formula: C16H15ClN4O4S2 MolecularWeight: 426.8977

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC1=NNC2=C(C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C\1CSC/C1=N/NC2=C(C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClN4O4S2/c17-11-2-1-3-12(8-11)20-27(24,25)14-4-5-15(16(9-14)21(22)23)19-18-13-6-7-26-10-13/h1-5,8-9,19-20H,6-7,10H2/b18-13+