5-[[(4-bromophenyl)amino]methyl]-N-[(4-methylphenyl)methyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[[(4-bromophenyl)amino]methyl]-N-[(4-methylphenyl)methyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[(4-bromoanilino)methyl]-N-(p-tolylmethyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[(4-bromoanilino)methyl]-N-[(4-methylphenyl)methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[(4-bromoanilino)methyl]-N-[(4-methylphenyl)methyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[(4-bromoanilino)methyl]-N-(4-methylbenzyl)-1,3,4-thiadiazole-2-carboxamide Formula: C18H17BrN4OS MolecularWeight: 417.32278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=NN=C(S2)CNC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=NN=C(S2)CNC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN4OS/c1-12-2-4-13(5-3-12)10-21-17(24)18-23-22-16(25-18)11-20-15-8-6-14(19)7-9-15/h2-9,20H,10-11H2,1H3,(H,21,24)