(5S,7R)-3-bromanyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-bromanyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)adamantane-1-carboxamide Openeye Name: (5S,7R)-3-bromo-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)adamantane-1-carboxamide CAS Name: (5S,7R)-3-bromo-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-bromo-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)adamantane-1-carboxamide Traditional Name: (5S,7R)-3-bromo-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide Formula: C15H20BrN3OS2 MolecularWeight: 402.3728

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Br

InChI

InChI=1S/C15H20BrN3OS2/c1-2-21-13-19-18-12(22-13)17-11(20)14-4-9-3-10(5-14)7-15(16,6-9)8-14/h9-10H,2-8H2,1H3,(H,17,18,20)/t9-,10+,14?,15?