1-(2-methyl-5-phenyl-3H-1,3,4-thiadiazol-2-yl)propan-2-one

Systemtic Name: 1-(2-methyl-5-phenyl-3H-1,3,4-thiadiazol-2-yl)propan-2-one Openeye Name: 1-(2-methyl-5-phenyl-3H-1,3,4-thiadiazol-2-yl)propan-2-one CAS Name: 1-(2-methyl-5-phenyl-3H-1,3,4-thiadiazol-2-yl)-2-propanone IUPAC Name: 1-(2-methyl-5-phenyl-3H-1,3,4-thiadiazol-2-yl)propan-2-one Traditional Name: 1-(2-methyl-5-phenyl-3H-1,3,4-thiadiazol-2-yl)acetone Formula: C12H14N2OS MolecularWeight: 234.31736

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1(NN=C(S1)C2=CC=CC=C2)C

Isomeric SMILES

CC(=O)CC1(NN=C(S1)C2=CC=CC=C2)C

InChI

InChI=1S/C12H14N2OS/c1-9(15)8-12(2)14-13-11(16-12)10-6-4-3-5-7-10/h3-7,14H,8H2,1-2H3