2-[3-(3-chloranylpyridin-4-yl)-5-oxidanylidene-4-(4-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[3-(3-chloranylpyridin-4-yl)-5-oxidanylidene-4-(4-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]-N-propyl-ethanamide Openeye Name: 2-[3-(3-chloro-4-pyridyl)-4-(4-isopropoxyphenyl)-5-oxo-1,2,4-triazol-1-yl]-N-propyl-acetamide CAS Name: 2-[3-(3-chloro-4-pyridinyl)-5-oxo-4-(4-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]-N-propylacetamide IUPAC Name: 2-[3-(3-chloropyridin-4-yl)-5-oxo-4-(4-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]-N-propylacetamide Traditional Name: 2-[3-(3-chloro-4-pyridyl)-4-(4-isopropoxyphenyl)-5-keto-1,2,4-triazol-1-yl]-N-propyl-acetamide Formula: C21H24ClN5O3 MolecularWeight: 429.89996

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1C(=O)N(C(=N1)C2=C(C=NC=C2)Cl)C3=CC=C(C=C3)OC(C)C

Isomeric SMILES

CCCNC(=O)CN1C(=O)N(C(=N1)C2=C(C=NC=C2)Cl)C3=CC=C(C=C3)OC(C)C

InChI

InChI=1S/C21H24ClN5O3/c1-4-10-24-19(28)13-26-21(29)27(15-5-7-16(8-6-15)30-14(2)3)20(25-26)17-9-11-23-12-18(17)22/h5-9,11-12,14H,4,10,13H2,1-3H3,(H,24,28)