4-chloranyl-N-[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-chloro-N-(5-isobutylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-chloro-N-[5-(2-methylpropylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-chloro-N-[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-chloro-N-[5-(isobutylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C13H14ClN3OS2 MolecularWeight: 327.85276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H14ClN3OS2/c1-8(2)7-19-13-17-16-12(20-13)15-11(18)9-3-5-10(14)6-4-9/h3-6,8H,7H2,1-2H3,(H,15,16,18)