N-[1-(1-adamantyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[1-(1-adamantyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[1-(1-adamantyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[1-(1-adamantyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Formula: C21H26N4O MolecularWeight: 350.45734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=C(C=C4)N5C=NC=N5

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=C(C=C4)N5C=NC=N5

InChI

InChI=1S/C21H26N4O/c1-14(21-9-15-6-16(10-21)8-17(7-15)11-21)24-20(26)18-2-4-19(5-3-18)25-13-22-12-23-25/h2-5,12-17H,6-11H2,1H3,(H,24,26)