2-(1-adamantylamino)-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]ethanamide

Systemtic Name: 2-(1-adamantylamino)-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]ethanamide Openeye Name: 2-(1-adamantylamino)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]acetamide CAS Name: 2-(1-adamantylamino)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]acetamide IUPAC Name: 2-(1-adamantylamino)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]acetamide Traditional Name: 2-(1-adamantylamino)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]acetamide Formula: C20H24ClN5O MolecularWeight: 385.89046

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NCC(=O)NC4=C(C=CC(=C4)Cl)N5C=NC=N5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NCC(=O)NC4=C(C=CC(=C4)Cl)N5C=NC=N5

InChI

InChI=1S/C20H24ClN5O/c21-16-1-2-18(26-12-22-11-24-26)17(6-16)25-19(27)10-23-20-7-13-3-14(8-20)5-15(4-13)9-20/h1-2,6,11-15,23H,3-5,7-10H2,(H,25,27)