3-nitro-N-[5-[(E)-thiophen-2-ylmethylideneamino]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-nitro-N-[5-[(E)-thiophen-2-ylmethylideneamino]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-nitro-N-[5-[(E)-2-thienylmethyleneamino]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-nitro-N-[5-[(E)-thiophen-2-ylmethylideneamino]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-nitro-N-[5-[(E)-thiophen-2-ylmethylideneamino]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-nitro-N-[5-[(E)-2-thenylideneamino]-1,3,4-thiadiazol-2-yl]benzamide Formula: C14H9N5O3S2 MolecularWeight: 359.38296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=NN=C(S2)N=CC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=NN=C(S2)/N=C/C3=CC=CS3

InChI

InChI=1S/C14H9N5O3S2/c20-12(9-3-1-4-10(7-9)19(21)22)16-14-18-17-13(24-14)15-8-11-5-2-6-23-11/h1-8H,(H,16,18,20)/b15-8+