N-[3-(3-nitrophenyl)-5-(phenylsulfonyl)-1,3,4-thiadiazol-2-ylidene]ethanamide

Systemtic Name: N-[3-(3-nitrophenyl)-5-(phenylsulfonyl)-1,3,4-thiadiazol-2-ylidene]ethanamide Openeye Name: N-[5-(benzenesulfonyl)-3-(3-nitrophenyl)-1,3,4-thiadiazol-2-ylidene]acetamide CAS Name: N-[5-(benzenesulfonyl)-3-(3-nitrophenyl)-1,3,4-thiadiazol-2-ylidene]acetamide IUPAC Name: N-[5-(benzenesulfonyl)-3-(3-nitrophenyl)-1,3,4-thiadiazol-2-ylidene]acetamide Traditional Name: N-[5-besyl-3-(3-nitrophenyl)-1,3,4-thiadiazol-2-ylidene]acetamide Formula: C16H12N4O5S2 MolecularWeight: 404.42028

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N=C1N(N=C(S1)S(=O)(=O)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N=C1N(N=C(S1)S(=O)(=O)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O5S2/c1-11(21)17-15-19(12-6-5-7-13(10-12)20(22)23)18-16(26-15)27(24,25)14-8-3-2-4-9-14/h2-10H,1H3