methyl (7S)-5-azanyl-6-cyano-2-methyl-7-(2,4,5-trimethoxyphenyl)-7H-thieno[3,2-b]pyran-3-carboxylate

Systemtic Name: methyl (7S)-5-azanyl-6-cyano-2-methyl-7-(2,4,5-trimethoxyphenyl)-7H-thieno[3,2-b]pyran-3-carboxylate Openeye Name: methyl (7S)-5-amino-6-cyano-2-methyl-7-(2,4,5-trimethoxyphenyl)-7H-thieno[3,2-b]pyran-3-carboxylate CAS Name: (7S)-5-amino-6-cyano-2-methyl-7-(2,4,5-trimethoxyphenyl)-7H-thieno[3,2-b]pyran-3-carboxylic acid methyl ester IUPAC Name: methyl (7S)-5-amino-6-cyano-2-methyl-7-(2,4,5-trimethoxyphenyl)-7H-thieno[3,2-b]pyran-3-carboxylate Traditional Name: (7S)-5-amino-7-asaryl-6-cyano-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylic acid methyl ester Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)C(C(=C(O2)N)C#N)C3=CC(=C(C=C3OC)OC)OC)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(S1)[C@H](C(=C(O2)N)C#N)C3=CC(=C(C=C3OC)OC)OC)C(=O)OC

InChI

InChI=1S/C20H20N2O6S/c1-9-15(20(23)27-5)17-18(29-9)16(11(8-21)19(22)28-17)10-6-13(25-3)14(26-4)7-12(10)24-2/h6-7,16H,22H2,1-5H3/t16-/m0/s1