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

Systemtic Name: N-[1-[[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-butyl-benzamide Openeye Name: N-[1-benzyl-2-[[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxo-ethyl]-4-butyl-benzamide CAS Name: N-[1-[[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-butylbenzamide IUPAC Name: N-[1-[[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-butylbenzamide Traditional Name: N-[1-benzyl-2-[[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-keto-ethyl]-4-butyl-benzamide Formula: C28H27BrN4O2S MolecularWeight: 563.50858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC3=NN=C(S3)C4=CC(=CC=C4)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC3=NN=C(S3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C28H27BrN4O2S/c1-2-3-8-19-13-15-21(16-14-19)25(34)30-24(17-20-9-5-4-6-10-20)26(35)31-28-33-32-27(36-28)22-11-7-12-23(29)18-22/h4-7,9-16,18,24H,2-3,8,17H2,1H3,(H,30,34)(H,31,33,35)