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

Systemtic Name: 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-bromanyl-3-methyl-phenyl)propanamide Openeye Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-bromo-3-methyl-phenyl)propanamide CAS Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-N-(4-bromo-3-methylphenyl)propanamide IUPAC Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-bromo-3-methylphenyl)propanamide Traditional Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-N-(4-bromo-3-methyl-phenyl)propionamide Formula: C12H13BrN4OS2 MolecularWeight: 373.29182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13BrN4OS2/c1-6-5-8(3-4-9(6)13)15-10(18)7(2)19-12-17-16-11(14)20-12/h3-5,7H,1-2H3,(H2,14,16)(H,15,18)