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

Systemtic Name: methyl (Z,4Z)-2-acetamido-4-(3-ethylsulfanyl-6-methyl-2H-1,2,4-triazin-5-ylidene)but-2-enoate Openeye Name: methyl (Z,4Z)-2-acetamido-4-(3-ethylsulfanyl-6-methyl-2H-1,2,4-triazin-5-ylidene)but-2-enoate CAS Name: (Z,4Z)-2-acetamido-4-[3-(ethylthio)-6-methyl-2H-1,2,4-triazin-5-ylidene]-2-butenoic acid methyl ester IUPAC Name: methyl (Z,4Z)-2-acetamido-4-(3-ethylsulfanyl-6-methyl-2H-1,2,4-triazin-5-ylidene)but-2-enoate Traditional Name: (Z,4Z)-2-acetamido-4-[3-(ethylthio)-6-methyl-2H-1,2,4-triazin-5-ylidene]but-2-enoic acid methyl ester Formula: C13H18N4O3S MolecularWeight: 310.37202

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=CC=C(C(=O)OC)NC(=O)C)C(=NN1)C

Isomeric SMILES

CCSC1=N/C(=C\C=C(\C(=O)OC)/NC(=O)C)/C(=NN1)C

InChI

InChI=1S/C13H18N4O3S/c1-5-21-13-15-10(8(2)16-17-13)6-7-11(12(19)20-4)14-9(3)18/h6-7H,5H2,1-4H3,(H,14,18)(H,15,17)/b10-6-,11-7-