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1,3-benzoxazol-2-ylmethyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate

1,3-benzoxazol-2-ylmethyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate

Systemtic Name:1,3-benzoxazol-2-ylmethyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate
Openeye Name:1,3-benzoxazol-2-ylmethyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate
CAS Name:3-cyano-6-cyclopropyl-2-(methylthio)-4-pyridinecarboxylic acid 1,3-benzoxazol-2-ylmethyl ester
IUPAC Name:1,3-benzoxazol-2-ylmethyl 3-cyano-6-cyclopropyl-2-methylsulfanylpyridine-4-carboxylate
Traditional Name:3-cyano-6-cyclopropyl-2-(methylthio)isonicotinic acid 1,3-benzoxazol-2-ylmethyl ester
Formula: C19H15N3O3S
MolecularWeight: 365.4057
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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=CC(=N1)C2CC2)C(=O)OCC3=NC4=CC=CC=C4O3)C#N


Isomeric SMILES

CSC1=C(C(=CC(=N1)C2CC2)C(=O)OCC3=NC4=CC=CC=C4O3)C#N


InChI

InChI=1S/C19H15N3O3S/c1-26-18-13(9-20)12(8-15(22-18)11-6-7-11)19(23)24-10-17-21-14-4-2-3-5-16(14)25-17/h2-5,8,11H,6-7,10H2,1H3


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