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

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-8-[[bis(2-hydroxyethyl)amino]methyl]-2,6-diethyl-7-oxidanyl-chromen-4-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-8-[[bis(2-hydroxyethyl)amino]methyl]-2,6-diethyl-7-hydroxy-chromen-4-one CAS Name: 3-(1,3-benzothiazol-2-yl)-8-[[bis(2-hydroxyethyl)amino]methyl]-2,6-diethyl-7-hydroxy-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-8-[[bis(2-hydroxyethyl)amino]methyl]-2,6-diethyl-7-hydroxychromen-4-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-8-[[bis(2-hydroxyethyl)amino]methyl]-2,6-diethyl-7-hydroxy-chromone Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)CC)C3=NC4=CC=CC=C4S3)CN(CCO)CCO)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)CC)C3=NC4=CC=CC=C4S3)CN(CCO)CCO)O

InChI

InChI=1S/C25H28N2O5S/c1-3-15-13-16-23(31)21(25-26-18-7-5-6-8-20(18)33-25)19(4-2)32-24(16)17(22(15)30)14-27(9-11-28)10-12-29/h5-8,13,28-30H,3-4,9-12,14H2,1-2H3