1-(1-adamantylcarbonyl)-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Formula: C24H27BrN4O2S MolecularWeight: 515.46578

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NC5=NN=C(S5)C6=CC=C(C=C6)Br

Isomeric SMILES

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NC5=NN=C(S5)C6=CC=C(C=C6)Br

InChI

InChI=1S/C24H27BrN4O2S/c25-18-5-3-17(4-6-18)21-27-28-23(32-21)26-20(30)19-2-1-7-29(19)22(31)24-11-14-8-15(12-24)10-16(9-14)13-24/h3-6,14-16,19H,1-2,7-13H2,(H,26,28,30)