ethyl (E)-2-cyano-3-methylsulfanyl-3-(pyridin-3-ylamino)prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-methylsulfanyl-3-(pyridin-3-ylamino)prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-methylsulfanyl-3-(3-pyridylamino)prop-2-enoate CAS Name: (E)-2-cyano-3-(methylthio)-3-(3-pyridinylamino)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-methylsulfanyl-3-(pyridin-3-ylamino)prop-2-enoate Traditional Name: (E)-2-cyano-3-(methylthio)-3-(3-pyridylamino)acrylic acid ethyl ester Formula: C12H13N3O2S MolecularWeight: 263.31552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(NC1=CN=CC=C1)SC)C#N

Isomeric SMILES

CCOC(=O)/C(=C(\NC1=CN=CC=C1)/SC)/C#N

InChI

InChI=1S/C12H13N3O2S/c1-3-17-12(16)10(7-13)11(18-2)15-9-5-4-6-14-8-9/h4-6,8,15H,3H2,1-2H3/b11-10+