4-chloranyl-N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]butanamide

Systemtic Name: 4-chloranyl-N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]butanamide Openeye Name: 4-chloro-N-[4-[3-ethoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]phenyl]butanamide CAS Name: 4-chloro-N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]butanamide IUPAC Name: 4-chloro-N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]butanamide Traditional Name: 4-chloro-N-[4-[3-ethoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]phenyl]butyramide Formula: C21H23ClN4O2 MolecularWeight: 398.88592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC=C(C=C2)C)C3=CC=C(C=C3)NC(=O)CCCCl

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC=C(C=C2)C)C3=CC=C(C=C3)NC(=O)CCCCl

InChI

InChI=1S/C21H23ClN4O2/c1-3-28-21-24-20(16-8-6-15(2)7-9-16)26(25-21)18-12-10-17(11-13-18)23-19(27)5-4-14-22/h6-13H,3-5,14H2,1-2H3,(H,23,27)