3-(3-bromanyl-1,2,4-triazol-1-yl)-N-propyl-adamantane-1-carboxamide

Systemtic Name: 3-(3-bromanyl-1,2,4-triazol-1-yl)-N-propyl-adamantane-1-carboxamide Openeye Name: 3-(3-bromo-1,2,4-triazol-1-yl)-N-propyl-adamantane-1-carboxamide CAS Name: 3-(3-bromo-1,2,4-triazol-1-yl)-N-propyl-1-adamantanecarboxamide IUPAC Name: 3-(3-bromo-1,2,4-triazol-1-yl)-N-propyladamantane-1-carboxamide Traditional Name: 3-(3-bromo-1,2,4-triazol-1-yl)-N-propyl-adamantane-1-carboxamide Formula: C16H23BrN4O MolecularWeight: 367.28402

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C12CC3CC(C1)CC(C3)(C2)N4C=NC(=N4)Br

Isomeric SMILES

CCCNC(=O)C12CC3CC(C1)CC(C3)(C2)N4C=NC(=N4)Br

InChI

InChI=1S/C16H23BrN4O/c1-2-3-18-13(22)15-5-11-4-12(6-15)8-16(7-11,9-15)21-10-19-14(17)20-21/h10-12H,2-9H2,1H3,(H,18,22)