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

Systemtic Name: N-[1-[[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-benzyl-2-[[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[1-[[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-[[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-benzyl-2-[[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-2-keto-ethyl]adamantane-1-carboxamide Formula: C28H29BrN4O2S MolecularWeight: 565.52446

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC(CC4=CC=CC=C4)C(=O)NC5=NN=C(S5)C6=CC(=CC=C6)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC(CC4=CC=CC=C4)C(=O)NC5=NN=C(S5)C6=CC(=CC=C6)Br

InChI

InChI=1S/C28H29BrN4O2S/c29-22-8-4-7-21(13-22)25-32-33-27(36-25)31-24(34)23(12-17-5-2-1-3-6-17)30-26(35)28-14-18-9-19(15-28)11-20(10-18)16-28/h1-8,13,18-20,23H,9-12,14-16H2,(H,30,35)(H,31,33,34)