(E)-4-(3-chlorophenyl)-3-(1,2,4-thiadiazol-5-yl)but-3-en-2-one

Systemtic Name: (E)-4-(3-chlorophenyl)-3-(1,2,4-thiadiazol-5-yl)but-3-en-2-one Openeye Name: (E)-4-(3-chlorophenyl)-3-(1,2,4-thiadiazol-5-yl)but-3-en-2-one CAS Name: (E)-4-(3-chlorophenyl)-3-(1,2,4-thiadiazol-5-yl)-3-buten-2-one IUPAC Name: (E)-4-(3-chlorophenyl)-3-(1,2,4-thiadiazol-5-yl)but-3-en-2-one Traditional Name: (E)-4-(3-chlorophenyl)-3-(1,2,4-thiadiazol-5-yl)but-3-en-2-one Formula: C12H9ClN2OS MolecularWeight: 264.73066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=CC=C1)Cl)C2=NC=NS2

Isomeric SMILES

CC(=O)/C(=C\C1=CC(=CC=C1)Cl)/C2=NC=NS2

InChI

InChI=1S/C12H9ClN2OS/c1-8(16)11(12-14-7-15-17-12)6-9-3-2-4-10(13)5-9/h2-7H,1H3/b11-6+