(E)-N-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]but-2-enamide

Systemtic Name: (E)-N-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]but-2-enamide Openeye Name: (E)-N-[5-(o-tolyl)-1,3,4-thiadiazol-2-yl]but-2-enamide CAS Name: (E)-N-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-butenamide IUPAC Name: (E)-N-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]but-2-enamide Traditional Name: (E)-N-[5-(o-tolyl)-1,3,4-thiadiazol-2-yl]but-2-enamide Formula: C13H13N3OS MolecularWeight: 259.32682

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NC1=NN=C(S1)C2=CC=CC=C2C

Isomeric SMILES

C/C=C/C(=O)NC1=NN=C(S1)C2=CC=CC=C2C

InChI

InChI=1S/C13H13N3OS/c1-3-6-11(17)14-13-16-15-12(18-13)10-8-5-4-7-9(10)2/h3-8H,1-2H3,(H,14,16,17)/b6-3+