N-[1-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-benzamide

Systemtic Name: N-[1-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-benzamide Openeye Name: N-[1-benzyl-2-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxo-ethyl]-4-methyl-benzamide CAS Name: N-[1-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-methylbenzamide IUPAC Name: N-[1-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-methylbenzamide Traditional Name: N-[1-benzyl-2-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-keto-ethyl]-4-methyl-benzamide Formula: C25H21BrN4O2S MolecularWeight: 521.42884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H21BrN4O2S/c1-16-7-9-18(10-8-16)22(31)27-21(15-17-5-3-2-4-6-17)23(32)28-25-30-29-24(33-25)19-11-13-20(26)14-12-19/h2-14,21H,15H2,1H3,(H,27,31)(H,28,30,32)