N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(p-tolylsulfanyl)propanamide CAS Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methylphenyl)thio]propanamide IUPAC Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(p-tolylthio)propionamide Formula: C18H16BrN3OS2 MolecularWeight: 434.37314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C)C(=O)NC2=NN=C(S2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)SC(C)C(=O)NC2=NN=C(S2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H16BrN3OS2/c1-11-3-9-15(10-4-11)24-12(2)16(23)20-18-22-21-17(25-18)13-5-7-14(19)8-6-13/h3-10,12H,1-2H3,(H,20,22,23)