propan-2-yl (4S)-2-azanyl-4-(2-chlorophenyl)-5-oxidanylidene-4H-thiochromeno[4,3-b]pyran-3-carboxylate

Systemtic Name: propan-2-yl (4S)-2-azanyl-4-(2-chlorophenyl)-5-oxidanylidene-4H-thiochromeno[4,3-b]pyran-3-carboxylate Openeye Name: isopropyl (4S)-2-amino-4-(2-chlorophenyl)-5-oxo-4H-thiochromeno[4,3-b]pyran-3-carboxylate CAS Name: (4S)-2-amino-4-(2-chlorophenyl)-5-oxo-4H-thiochromeno[4,3-b]pyran-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (4S)-2-amino-4-(2-chlorophenyl)-5-oxo-4H-thiochromeno[4,3-b]pyran-3-carboxylate Traditional Name: (4S)-2-amino-4-(2-chlorophenyl)-5-keto-4H-thiochromeno[4,3-b]pyran-3-carboxylic acid isopropyl ester Formula: C22H18ClNO4S MolecularWeight: 427.90062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(OC2=C(C1C3=CC=CC=C3Cl)C(=O)SC4=CC=CC=C42)N

Isomeric SMILES

CC(C)OC(=O)C1=C(OC2=C([C@H]1C3=CC=CC=C3Cl)C(=O)SC4=CC=CC=C42)N

InChI

InChI=1S/C22H18ClNO4S/c1-11(2)27-21(25)18-16(12-7-3-5-9-14(12)23)17-19(28-20(18)24)13-8-4-6-10-15(13)29-22(17)26/h3-11,16H,24H2,1-2H3/t16-/m1/s1