N-tert-butyl-2-[5-[[(4-chlorophenyl)amino]methyl]-1H-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[5-[[(4-chlorophenyl)amino]methyl]-1H-1,2,4-triazol-3-yl]ethanamide Openeye Name: N-tert-butyl-2-[5-[(4-chloroanilino)methyl]-1H-1,2,4-triazol-3-yl]acetamide CAS Name: N-tert-butyl-2-[5-[(4-chloroanilino)methyl]-1H-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-tert-butyl-2-[5-[(4-chloroanilino)methyl]-1H-1,2,4-triazol-3-yl]acetamide Traditional Name: N-tert-butyl-2-[5-[(4-chloroanilino)methyl]-1H-1,2,4-triazol-3-yl]acetamide Formula: C15H20ClN5O MolecularWeight: 321.8052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CC1=NNC(=N1)CNC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)NC(=O)CC1=NNC(=N1)CNC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H20ClN5O/c1-15(2,3)19-14(22)8-12-18-13(21-20-12)9-17-11-6-4-10(16)5-7-11/h4-7,17H,8-9H2,1-3H3,(H,19,22)(H,18,20,21)