N-(4-bromophenyl)-4-[[5-(propanoylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-(4-bromophenyl)-4-[[5-(propanoylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzamide Openeye Name: N-(4-bromophenyl)-4-[[5-(propanoylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzamide CAS Name: N-(4-bromophenyl)-4-[[[5-(1-oxopropylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzamide IUPAC Name: N-(4-bromophenyl)-4-[[5-(propanoylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzamide Traditional Name: N-(4-bromophenyl)-4-[[(5-propionamido-1,3,4-thiadiazol-2-yl)thio]methyl]benzamide Formula: C19H17BrN4O2S2 MolecularWeight: 477.39788

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NN=C(S1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CCC(=O)NC1=NN=C(S1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN4O2S2/c1-2-16(25)22-18-23-24-19(28-18)27-11-12-3-5-13(6-4-12)17(26)21-15-9-7-14(20)8-10-15/h3-10H,2,11H2,1H3,(H,21,26)(H,22,23,25)