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

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C14H17BrN4OS2 MolecularWeight: 401.34498

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NN=C(S1)SCC(=O)NC2=CC(=C(C=C2)Br)C

Isomeric SMILES

CCCNC1=NN=C(S1)SCC(=O)NC2=CC(=C(C=C2)Br)C

InChI

InChI=1S/C14H17BrN4OS2/c1-3-6-16-13-18-19-14(22-13)21-8-12(20)17-10-4-5-11(15)9(2)7-10/h4-5,7H,3,6,8H2,1-2H3,(H,16,18)(H,17,20)