ethyl (E)-2-cyano-3-[2-(4-methoxyphenyl)carbonylhydrazinyl]-3-sulfanyl-prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[2-(4-methoxyphenyl)carbonylhydrazinyl]-3-sulfanyl-prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[2-(4-methoxybenzoyl)hydrazino]-3-sulfanyl-prop-2-enoate CAS Name: (E)-2-cyano-3-mercapto-3-[[(4-methoxyphenyl)-oxomethyl]hydrazo]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[2-(4-methoxybenzoyl)hydrazinyl]-3-sulfanylprop-2-enoate Traditional Name: (E)-2-cyano-3-mercapto-3-(N'-p-anisoylhydrazino)acrylic acid ethyl ester Formula: C14H15N3O4S MolecularWeight: 321.3516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(NNC(=O)C1=CC=C(C=C1)OC)S)C#N

Isomeric SMILES

CCOC(=O)/C(=C(\NNC(=O)C1=CC=C(C=C1)OC)/S)/C#N

InChI

InChI=1S/C14H15N3O4S/c1-3-21-14(19)11(8-15)13(22)17-16-12(18)9-4-6-10(20-2)7-5-9/h4-7,17,22H,3H2,1-2H3,(H,16,18)/b13-11+