(2S)-N-(2-bromanyl-4-methyl-phenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide

Systemtic Name: (2S)-N-(2-bromanyl-4-methyl-phenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Openeye Name: (2S)-N-(2-bromo-4-methyl-phenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide CAS Name: (2S)-N-(2-bromo-4-methylphenyl)-2-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: (2S)-N-(2-bromo-4-methylphenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Traditional Name: (2S)-N-(2-bromo-4-methyl-phenyl)-2-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]propionamide Formula: C13H14BrN3OS3 MolecularWeight: 404.36876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NN=C(S2)SC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@H](C)SC2=NN=C(S2)SC)Br

InChI

InChI=1S/C13H14BrN3OS3/c1-7-4-5-10(9(14)6-7)15-11(18)8(2)20-13-17-16-12(19-3)21-13/h4-6,8H,1-3H3,(H,15,18)/t8-/m0/s1