ethyl 3-(1,3-benzothiazol-2-yl)-8-methyl-6-[(2-methylpiperidin-1-yl)methyl]-7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-yl)-8-methyl-6-[(2-methylpiperidin-1-yl)methyl]-7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-[(2-methyl-1-piperidyl)methyl]-4-oxo-chromene-2-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-[(2-methyl-1-piperidinyl)methyl]-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-[(2-methylpiperidin-1-yl)methyl]-4-oxochromene-2-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-4-keto-8-methyl-6-[(2-methylpiperidino)methyl]chromene-2-carboxylic acid ethyl ester Formula: C27H28N2O5S MolecularWeight: 492.58662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=CC(=C(C(=C2O1)C)O)CN3CCCCC3C)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=CC(=C(C(=C2O1)C)O)CN3CCCCC3C)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H28N2O5S/c1-4-33-27(32)25-21(26-28-19-10-5-6-11-20(19)35-26)23(31)18-13-17(22(30)16(3)24(18)34-25)14-29-12-8-7-9-15(29)2/h5-6,10-11,13,15,30H,4,7-9,12,14H2,1-3H3