oxolan-2-ylmethyl (E)-2-cyano-3-[(6-fluoranylpyridin-3-yl)methylamino]-3-methylsulfanyl-prop-2-enoate

Systemtic Name: oxolan-2-ylmethyl (E)-2-cyano-3-[(6-fluoranylpyridin-3-yl)methylamino]-3-methylsulfanyl-prop-2-enoate Openeye Name: tetrahydrofuran-2-ylmethyl (E)-2-cyano-3-[(6-fluoro-3-pyridyl)methylamino]-3-methylsulfanyl-prop-2-enoate CAS Name: (E)-2-cyano-3-[(6-fluoro-3-pyridinyl)methylamino]-3-(methylthio)-2-propenoic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl (E)-2-cyano-3-[(6-fluoropyridin-3-yl)methylamino]-3-methylsulfanylprop-2-enoate Traditional Name: (E)-2-cyano-3-[(6-fluoro-3-pyridyl)methylamino]-3-(methylthio)acrylic acid tetrahydrofurfuryl ester Formula: C16H18FN3O3S MolecularWeight: 351.395823

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C#N)C(=O)OCC1CCCO1)NCC2=CN=C(C=C2)F

Isomeric SMILES

CS/C(=C(\C#N)/C(=O)OCC1CCCO1)/NCC2=CN=C(C=C2)F

InChI

InChI=1S/C16H18FN3O3S/c1-24-15(20-9-11-4-5-14(17)19-8-11)13(7-18)16(21)23-10-12-3-2-6-22-12/h4-5,8,12,20H,2-3,6,9-10H2,1H3/b15-13+