N-[3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-2-ylidene]benzamide

Systemtic Name: N-[3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-2-ylidene]benzamide Openeye Name: N-[3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-2-ylidene]benzamide CAS Name: N-[3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-2-ylidene]benzamide IUPAC Name: N-[3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-2-ylidene]benzamide Traditional Name: N-[3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-2-ylidene]benzamide Formula: C21H14N4O3S MolecularWeight: 402.42586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=NC(=O)C3=CC=CC=C3)S2)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=NC(=O)C3=CC=CC=C3)S2)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14N4O3S/c26-19(15-7-3-1-4-8-15)22-21-24(17-11-13-18(14-12-17)25(27)28)23-20(29-21)16-9-5-2-6-10-16/h1-14H