2-ethoxyethyl (E)-2-cyano-3-[(6-methoxypyridin-3-yl)methylamino]-3-methylsulfanyl-prop-2-enoate

Systemtic Name: 2-ethoxyethyl (E)-2-cyano-3-[(6-methoxypyridin-3-yl)methylamino]-3-methylsulfanyl-prop-2-enoate Openeye Name: 2-ethoxyethyl (E)-2-cyano-3-[(6-methoxy-3-pyridyl)methylamino]-3-methylsulfanyl-prop-2-enoate CAS Name: (E)-2-cyano-3-[(6-methoxy-3-pyridinyl)methylamino]-3-(methylthio)-2-propenoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl (E)-2-cyano-3-[(6-methoxypyridin-3-yl)methylamino]-3-methylsulfanylprop-2-enoate Traditional Name: (E)-2-cyano-3-[(6-methoxy-3-pyridyl)methylamino]-3-(methylthio)acrylic acid 2-ethoxyethyl ester Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C(=C(NCC1=CN=C(C=C1)OC)SC)C#N

Isomeric SMILES

CCOCCOC(=O)/C(=C(\NCC1=CN=C(C=C1)OC)/SC)/C#N

InChI

InChI=1S/C16H21N3O4S/c1-4-22-7-8-23-16(20)13(9-17)15(24-3)19-11-12-5-6-14(21-2)18-10-12/h5-6,10,19H,4,7-8,11H2,1-3H3/b15-13+