N-[3-[3-(2-chloranylprop-2-enylsulfanyl)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]ethanamide

Systemtic Name: N-[3-[3-(2-chloranylprop-2-enylsulfanyl)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-[3-(2-chloroallylsulfanyl)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]acetamide CAS Name: N-[3-[3-(2-chloroprop-2-enylthio)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-[3-(2-chloroprop-2-enylsulfanyl)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]acetamide Traditional Name: N-[3-[3-(2-chloroallylthio)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C16H17ClN4OS MolecularWeight: 348.85038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)N2C(=NN=C2SCC(=C)Cl)C3CC3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)N2C(=NN=C2SCC(=C)Cl)C3CC3

InChI

InChI=1S/C16H17ClN4OS/c1-10(17)9-23-16-20-19-15(12-6-7-12)21(16)14-5-3-4-13(8-14)18-11(2)22/h3-5,8,12H,1,6-7,9H2,2H3,(H,18,22)