2-[[5-(4-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: 2-[[5-(4-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[[4-allyl-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[[5-(4-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 2-[[5-(4-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 2-[[4-allyl-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C14H15ClN4OS MolecularWeight: 322.8131

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)SC1=NN=C(N1CC=C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)N)SC1=NN=C(N1CC=C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H15ClN4OS/c1-3-8-19-13(10-4-6-11(15)7-5-10)17-18-14(19)21-9(2)12(16)20/h3-7,9H,1,8H2,2H3,(H2,16,20)