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

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-methylpropyl)amino]methyl]-8-methyl-7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 3-(1,3-benzothiazol-2-yl)-6-[(diisobutylamino)methyl]-7-hydroxy-8-methyl-4-oxo-chromene-2-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-methylpropyl)amino]methyl]-7-hydroxy-8-methyl-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-methylpropyl)amino]methyl]-7-hydroxy-8-methyl-4-oxochromene-2-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)-6-[(diisobutylamino)methyl]-7-hydroxy-4-keto-8-methyl-chromene-2-carboxylic acid ethyl ester Formula: C29H34N2O5S MolecularWeight: 522.65566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=CC(=C(C(=C2O1)C)O)CN(CC(C)C)CC(C)C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=CC(=C(C(=C2O1)C)O)CN(CC(C)C)CC(C)C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C29H34N2O5S/c1-7-35-29(34)27-23(28-30-21-10-8-9-11-22(21)37-28)25(33)20-12-19(24(32)18(6)26(20)36-27)15-31(13-16(2)3)14-17(4)5/h8-12,16-17,32H,7,13-15H2,1-6H3