3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-2-ethyl-8-methyl-7-oxidanyl-chromen-4-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-2-ethyl-8-methyl-7-oxidanyl-chromen-4-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-2-ethyl-7-hydroxy-8-methyl-chromen-4-one CAS Name: 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-2-ethyl-7-hydroxy-8-methyl-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-2-ethyl-7-hydroxy-8-methylchromen-4-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-6-[[bis(2-hydroxyethyl)amino]methyl]-2-ethyl-7-hydroxy-8-methyl-chromone Formula: C24H26N2O5S MolecularWeight: 454.53864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C2=CC(=C(C(=C2O1)C)O)CN(CCO)CCO)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=C(C(=O)C2=CC(=C(C(=C2O1)C)O)CN(CCO)CCO)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H26N2O5S/c1-3-18-20(24-25-17-6-4-5-7-19(17)32-24)22(30)16-12-15(13-26(8-10-27)9-11-28)21(29)14(2)23(16)31-18/h4-7,12,27-29H,3,8-11,13H2,1-2H3