methyl (4R)-6-azanyl-4-[5-[[2,5-bis(chloranyl)phenyl]sulfanylmethyl]-2,4-dimethyl-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: methyl (4R)-6-azanyl-4-[5-[[2,5-bis(chloranyl)phenyl]sulfanylmethyl]-2,4-dimethyl-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: methyl (4R)-6-amino-5-cyano-4-[5-[(2,5-dichlorophenyl)sulfanylmethyl]-2,4-dimethyl-phenyl]-2-methyl-4H-pyran-3-carboxylate CAS Name: (4R)-6-amino-5-cyano-4-[5-[[(2,5-dichlorophenyl)thio]methyl]-2,4-dimethylphenyl]-2-methyl-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl (4R)-6-amino-5-cyano-4-[5-[(2,5-dichlorophenyl)sulfanylmethyl]-2,4-dimethylphenyl]-2-methyl-4H-pyran-3-carboxylate Traditional Name: (4R)-6-amino-5-cyano-4-[5-[[(2,5-dichlorophenyl)thio]methyl]-2,4-dimethyl-phenyl]-2-methyl-4H-pyran-3-carboxylic acid methyl ester Formula: C24H22Cl2N2O3S MolecularWeight: 489.41408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2C(=C(OC(=C2C(=O)OC)C)N)C#N)CSC3=C(C=CC(=C3)Cl)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1[C@@H]2C(=C(OC(=C2C(=O)OC)C)N)C#N)CSC3=C(C=CC(=C3)Cl)Cl)C

InChI

InChI=1S/C24H22Cl2N2O3S/c1-12-7-13(2)17(8-15(12)11-32-20-9-16(25)5-6-19(20)26)22-18(10-27)23(28)31-14(3)21(22)24(29)30-4/h5-9,22H,11,28H2,1-4H3/t22-/m1/s1