ethyl 5-cyano-6-[2-[[(1R)-1-cyclopropylethyl]amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[2-[[(1R)-1-cyclopropylethyl]amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-[[(1R)-1-cyclopropylethyl]amino]-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-[[(1R)-1-cyclopropylethyl]amino]-2-oxoethyl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-[[(1R)-1-cyclopropylethyl]amino]-2-oxoethyl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-[[(1R)-1-cyclopropylethyl]amino]-2-keto-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC(C)C2CC2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)N[C@H](C)C2CC2)C

InChI

InChI=1S/C17H21N3O3S/c1-4-23-17(22)14-7-13(8-18)16(20-11(14)3)24-9-15(21)19-10(2)12-5-6-12/h7,10,12H,4-6,9H2,1-3H3,(H,19,21)/t10-/m1/s1