N-[1-(4-chlorophenyl)-3-ethanoyl-5-ethyl-5-methyl-1,2,4-triazol-4-yl]benzamide

Systemtic Name: N-[1-(4-chlorophenyl)-3-ethanoyl-5-ethyl-5-methyl-1,2,4-triazol-4-yl]benzamide Openeye Name: N-[3-acetyl-1-(4-chlorophenyl)-5-ethyl-5-methyl-1,2,4-triazol-4-yl]benzamide CAS Name: N-[3-acetyl-1-(4-chlorophenyl)-5-ethyl-5-methyl-1,2,4-triazol-4-yl]benzamide IUPAC Name: N-[3-acetyl-1-(4-chlorophenyl)-5-ethyl-5-methyl-1,2,4-triazol-4-yl]benzamide Traditional Name: N-[3-acetyl-1-(4-chlorophenyl)-5-ethyl-5-methyl-1,2,4-triazol-4-yl]benzamide Formula: C20H21ClN4O2 MolecularWeight: 384.85934

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(N(N=C(N1NC(=O)C2=CC=CC=C2)C(=O)C)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCC1(N(N=C(N1NC(=O)C2=CC=CC=C2)C(=O)C)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C20H21ClN4O2/c1-4-20(3)24(17-12-10-16(21)11-13-17)22-18(14(2)26)25(20)23-19(27)15-8-6-5-7-9-15/h5-13H,4H2,1-3H3,(H,23,27)