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

Systemtic Name: 3-methyl-N-[5-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-methyl-N-[5-[(E)-(5-nitro-2-thienyl)methyleneamino]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-methyl-N-[5-[(E)-(5-nitro-2-thiophenyl)methylideneamino]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-methyl-N-[5-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-methyl-N-[5-[(E)-(5-nitro-2-thienyl)methyleneamino]-1,3,4-thiadiazol-2-yl]benzamide Formula: C15H11N5O3S2 MolecularWeight: 373.40954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)N=CC3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)/N=C/C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N5O3S2/c1-9-3-2-4-10(7-9)13(21)17-15-19-18-14(25-15)16-8-11-5-6-12(24-11)20(22)23/h2-8H,1H3,(H,17,19,21)/b16-8+