methyl 6-azanyl-5-cyano-2-[(3-cyano-6-methyl-pyridin-2-yl)sulfanylmethyl]-4-(4-ethylphenyl)-4H-pyran-3-carboxylate

Systemtic Name: methyl 6-azanyl-5-cyano-2-[(3-cyano-6-methyl-pyridin-2-yl)sulfanylmethyl]-4-(4-ethylphenyl)-4H-pyran-3-carboxylate Openeye Name: methyl 6-amino-5-cyano-2-[(3-cyano-6-methyl-2-pyridyl)sulfanylmethyl]-4-(4-ethylphenyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-2-[[(3-cyano-6-methyl-2-pyridinyl)thio]methyl]-4-(4-ethylphenyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-5-cyano-2-[(3-cyano-6-methylpyridin-2-yl)sulfanylmethyl]-4-(4-ethylphenyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-2-[[(3-cyano-6-methyl-2-pyridyl)thio]methyl]-4-(4-ethylphenyl)-4H-pyran-3-carboxylic acid methyl ester Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C(=C(OC(=C2C(=O)OC)CSC3=C(C=CC(=N3)C)C#N)N)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2C(=C(OC(=C2C(=O)OC)CSC3=C(C=CC(=N3)C)C#N)N)C#N

InChI

InChI=1S/C24H22N4O3S/c1-4-15-6-9-16(10-7-15)20-18(12-26)22(27)31-19(21(20)24(29)30-3)13-32-23-17(11-25)8-5-14(2)28-23/h5-10,20H,4,13,27H2,1-3H3