ethyl 6-azanyl-5-cyano-4-(4-methoxyphenyl)-2-(phenylsulfanylmethyl)-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-5-cyano-4-(4-methoxyphenyl)-2-(phenylsulfanylmethyl)-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-4-(4-methoxyphenyl)-2-(phenylsulfanylmethyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-(4-methoxyphenyl)-2-[(phenylthio)methyl]-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-4-(4-methoxyphenyl)-2-(phenylsulfanylmethyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-(4-methoxyphenyl)-2-[(phenylthio)methyl]-4H-pyran-3-carboxylic acid ethyl ester Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)OC)C#N)N)CSC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)OC)C#N)N)CSC3=CC=CC=C3

InChI

InChI=1S/C23H22N2O4S/c1-3-28-23(26)21-19(14-30-17-7-5-4-6-8-17)29-22(25)18(13-24)20(21)15-9-11-16(27-2)12-10-15/h4-12,20H,3,14,25H2,1-2H3