4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N'-[(E)-1-phenylbut-1-enyl]benzohydrazide

Systemtic Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N'-[(E)-1-phenylbut-1-enyl]benzohydrazide Openeye Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N'-[(E)-1-phenylbut-1-enyl]benzohydrazide CAS Name: 4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-N'-[(E)-1-phenylbut-1-enyl]benzohydrazide IUPAC Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N'-[(E)-1-phenylbut-1-enyl]benzohydrazide Traditional Name: 4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-N'-[(E)-1-phenylbut-1-enyl]benzohydrazide Formula: C21H23N5OS MolecularWeight: 393.50522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C1=CC=CC=C1)NNC(=O)C2=CC=C(C=C2)CSC3=NN=CN3C

Isomeric SMILES

CC/C=C(\C1=CC=CC=C1)/NNC(=O)C2=CC=C(C=C2)CSC3=NN=CN3C

InChI

InChI=1S/C21H23N5OS/c1-3-7-19(17-8-5-4-6-9-17)23-24-20(27)18-12-10-16(11-13-18)14-28-21-25-22-15-26(21)2/h4-13,15,23H,3,14H2,1-2H3,(H,24,27)/b19-7+