4-bromanyl-N-[5-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-bromanyl-N-[5-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-bromo-N-[5-[(E)-(5-nitro-2-thienyl)methyleneamino]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-bromo-N-[5-[(E)-(5-nitro-2-thiophenyl)methylideneamino]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-bromo-N-[5-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-bromo-N-[5-[(E)-(5-nitro-2-thienyl)methyleneamino]-1,3,4-thiadiazol-2-yl]benzamide Formula: C14H8BrN5O3S2 MolecularWeight: 438.27902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=NN=C(S2)N=CC3=CC=C(S3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=NN=C(S2)/N=C/C3=CC=C(S3)[N+](=O)[O-])Br

InChI

InChI=1S/C14H8BrN5O3S2/c15-9-3-1-8(2-4-9)12(21)17-14-19-18-13(25-14)16-7-10-5-6-11(24-10)20(22)23/h1-7H,(H,17,19,21)/b16-7+