5-bromanyl-N-[5-[(2S)-butan-2-yl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-chloranyl-benzamide

Systemtic Name: 5-bromanyl-N-[5-[(2S)-butan-2-yl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-chloranyl-benzamide Openeye Name: 5-bromo-2-chloro-N-[5-[(1S)-1-methylpropyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 5-bromo-N-[5-[[(2S)-butan-2-yl]thio]-1,3,4-thiadiazol-2-yl]-2-chlorobenzamide IUPAC Name: 5-bromo-N-[5-[(2S)-butan-2-yl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-chlorobenzamide Traditional Name: 5-bromo-2-chloro-N-[5-[[(1S)-1-methylpropyl]thio]-1,3,4-thiadiazol-2-yl]benzamide Formula: C13H13BrClN3OS2 MolecularWeight: 406.74882

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NN=C(S1)NC(=O)C2=C(C=CC(=C2)Br)Cl

Isomeric SMILES

CC[C@H](C)SC1=NN=C(S1)NC(=O)C2=C(C=CC(=C2)Br)Cl

InChI

InChI=1S/C13H13BrClN3OS2/c1-3-7(2)20-13-18-17-12(21-13)16-11(19)9-6-8(14)4-5-10(9)15/h4-7H,3H2,1-2H3,(H,16,17,19)/t7-/m0/s1