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

Systemtic Name: N-(4-chlorophenyl)-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 3-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-chlorophenyl)propanamide CAS Name: N-(4-chlorophenyl)-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-chlorophenyl)-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 3-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(4-chlorophenyl)propionamide Formula: C15H17ClN4OS MolecularWeight: 336.83968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H17ClN4OS/c1-3-9-20-11(2)18-19-15(20)22-10-8-14(21)17-13-6-4-12(16)5-7-13/h3-7H,1,8-10H2,2H3,(H,17,21)