1,3-benzodioxol-5-ylmethyl (Z,4Z)-2-benzamido-4-(3-ethylsulfanyl-6-methyl-2H-1,2,4-triazin-5-ylidene)but-2-enoate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl (Z,4Z)-2-benzamido-4-(3-ethylsulfanyl-6-methyl-2H-1,2,4-triazin-5-ylidene)but-2-enoate Openeye Name: 1,3-benzodioxol-5-ylmethyl (Z,4Z)-2-benzamido-4-(3-ethylsulfanyl-6-methyl-2H-1,2,4-triazin-5-ylidene)but-2-enoate CAS Name: (Z,4Z)-2-benzamido-4-[3-(ethylthio)-6-methyl-2H-1,2,4-triazin-5-ylidene]-2-butenoic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl (Z,4Z)-2-benzamido-4-(3-ethylsulfanyl-6-methyl-2H-1,2,4-triazin-5-ylidene)but-2-enoate Traditional Name: (Z,4Z)-2-benzamido-4-[3-(ethylthio)-6-methyl-2H-1,2,4-triazin-5-ylidene]but-2-enoic acid piperonyl ester Formula: C25H24N4O5S MolecularWeight: 492.54686

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=CC=C(C(=O)OCC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CC=C4)C(=NN1)C

Isomeric SMILES

CCSC1=N/C(=C\C=C(\C(=O)OCC2=CC3=C(C=C2)OCO3)/NC(=O)C4=CC=CC=C4)/C(=NN1)C

InChI

InChI=1S/C25H24N4O5S/c1-3-35-25-27-19(16(2)28-29-25)10-11-20(26-23(30)18-7-5-4-6-8-18)24(31)32-14-17-9-12-21-22(13-17)34-15-33-21/h4-13H,3,14-15H2,1-2H3,(H,26,30)(H,27,29)/b19-10-,20-11-