N-[4-ethanoyl-5-methyl-5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: N-[4-ethanoyl-5-methyl-5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-[4-acetyl-5-methyl-5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-[4-acetyl-5-methyl-5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: N-[4-acetyl-5-methyl-5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: N-[4-acetyl-5-methyl-5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]acetamide Formula: C13H14N4O4S MolecularWeight: 322.33966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NN(C(S1)(C)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC(=O)NC1=NN(C(S1)(C)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C13H14N4O4S/c1-8(18)14-12-15-16(9(2)19)13(3,22-12)10-4-6-11(7-5-10)17(20)21/h4-7H,1-3H3,(H,14,15,18)