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

Systemtic Name: ethyl (Z,4Z)-2-benzamido-4-(3-ethylsulfanyl-6-methyl-2H-1,2,4-triazin-5-ylidene)but-2-enoate Openeye Name: ethyl (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 ethyl ester IUPAC Name: ethyl (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 ethyl ester Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC=C1C(=NNC(=N1)SCC)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C(=C/C=C\1/C(=NNC(=N1)SCC)C)/NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H22N4O3S/c1-4-26-18(25)16(20-17(24)14-9-7-6-8-10-14)12-11-15-13(3)22-23-19(21-15)27-5-2/h6-12H,4-5H2,1-3H3,(H,20,24)(H,21,23)/b15-11-,16-12-