N-(1-adamantyl)-1-(3-bromophenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(1-adamantyl)-1-(3-bromophenyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(1-adamantyl)-1-(3-bromophenyl)triazole-4-carboxamide CAS Name: N-(1-adamantyl)-1-(3-bromophenyl)-4-triazolecarboxamide IUPAC Name: N-(1-adamantyl)-1-(3-bromophenyl)triazole-4-carboxamide Traditional Name: N-(1-adamantyl)-1-(3-bromophenyl)triazole-4-carboxamide Formula: C19H21BrN4O MolecularWeight: 401.30024

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CN(N=N4)C5=CC(=CC=C5)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CN(N=N4)C5=CC(=CC=C5)Br

InChI

InChI=1S/C19H21BrN4O/c20-15-2-1-3-16(7-15)24-11-17(22-23-24)18(25)21-19-8-12-4-13(9-19)6-14(5-12)10-19/h1-3,7,11-14H,4-6,8-10H2,(H,21,25)