3-(1,3-benzothiazol-2-yl)-8-methyl-7-oxidanyl-6-(piperidin-1-ylmethyl)chromen-4-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-8-methyl-7-oxidanyl-6-(piperidin-1-ylmethyl)chromen-4-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-(1-piperidylmethyl)chromen-4-one CAS Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-(1-piperidinylmethyl)-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-(piperidin-1-ylmethyl)chromen-4-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-(piperidinomethyl)chromone Formula: C23H22N2O3S MolecularWeight: 406.49738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1O)CN3CCCCC3)C(=O)C(=CO2)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C2C(=CC(=C1O)CN3CCCCC3)C(=O)C(=CO2)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H22N2O3S/c1-14-20(26)15(12-25-9-5-2-6-10-25)11-16-21(27)17(13-28-22(14)16)23-24-18-7-3-4-8-19(18)29-23/h3-4,7-8,11,13,26H,2,5-6,9-10,12H2,1H3