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

Systemtic Name: N-(2-chloranylpyridin-3-yl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide Openeye Name: N-(2-chloro-3-pyridyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide CAS Name: N-(2-chloro-3-pyridinyl)-3-(1,2,4-triazol-1-yl)-1-adamantanecarboxamide IUPAC Name: N-(2-chloropyridin-3-yl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide Traditional Name: N-(2-chloro-3-pyridyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide Formula: C18H20ClN5O MolecularWeight: 357.8373

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)N4C=NC=N4)C(=O)NC5=C(N=CC=C5)Cl

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)N4C=NC=N4)C(=O)NC5=C(N=CC=C5)Cl

InChI

InChI=1S/C18H20ClN5O/c19-15-14(2-1-3-21-15)23-16(25)17-5-12-4-13(6-17)8-18(7-12,9-17)24-11-20-10-22-24/h1-3,10-13H,4-9H2,(H,23,25)