1-(4-chlorophenyl)-5-methyl-N-(3-phenylmethoxypropyl)-1,2,4-triazole-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-5-methyl-N-(3-phenylmethoxypropyl)-1,2,4-triazole-3-carboxamide Openeye Name: N-(3-benzyloxypropyl)-1-(4-chlorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide CAS Name: 1-(4-chlorophenyl)-5-methyl-N-(3-phenylmethoxypropyl)-1,2,4-triazole-3-carboxamide IUPAC Name: 1-(4-chlorophenyl)-5-methyl-N-(3-phenylmethoxypropyl)-1,2,4-triazole-3-carboxamide Traditional Name: N-(3-benzoxypropyl)-1-(4-chlorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Formula: C20H21ClN4O2 MolecularWeight: 384.85934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)Cl)C(=O)NCCCOCC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)Cl)C(=O)NCCCOCC3=CC=CC=C3

InChI

InChI=1S/C20H21ClN4O2/c1-15-23-19(24-25(15)18-10-8-17(21)9-11-18)20(26)22-12-5-13-27-14-16-6-3-2-4-7-16/h2-4,6-11H,5,12-14H2,1H3,(H,22,26)