(3R)-1-(4-chlorophenyl)carbonyl-3-(1,3,4-thiadiazol-2-ylsulfanyl)azepan-2-one

Systemtic Name: (3R)-1-(4-chlorophenyl)carbonyl-3-(1,3,4-thiadiazol-2-ylsulfanyl)azepan-2-one Openeye Name: (3R)-1-(4-chlorobenzoyl)-3-(1,3,4-thiadiazol-2-ylsulfanyl)azepan-2-one CAS Name: (3R)-1-[(4-chlorophenyl)-oxomethyl]-3-(1,3,4-thiadiazol-2-ylthio)-2-azepanone IUPAC Name: (3R)-1-(4-chlorobenzoyl)-3-(1,3,4-thiadiazol-2-ylsulfanyl)azepan-2-one Traditional Name: (3R)-1-(4-chlorobenzoyl)-3-(1,3,4-thiadiazol-2-ylthio)azepan-2-one Formula: C15H14ClN3O2S2 MolecularWeight: 367.87356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)SC2=NN=CS2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C(=O)[C@@H](C1)SC2=NN=CS2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H14ClN3O2S2/c16-11-6-4-10(5-7-11)13(20)19-8-2-1-3-12(14(19)21)23-15-18-17-9-22-15/h4-7,9,12H,1-3,8H2/t12-/m1/s1