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

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-2-ethyl-8-methyl-7-oxidanyl-6-(piperidin-1-ylmethyl)chromen-4-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-2-ethyl-7-hydroxy-8-methyl-6-(1-piperidylmethyl)chromen-4-one CAS Name: 3-(1,3-benzothiazol-2-yl)-2-ethyl-7-hydroxy-8-methyl-6-(1-piperidinylmethyl)-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-2-ethyl-7-hydroxy-8-methyl-6-(piperidin-1-ylmethyl)chromen-4-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-2-ethyl-7-hydroxy-8-methyl-6-(piperidinomethyl)chromone Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C2=CC(=C(C(=C2O1)C)O)CN3CCCCC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCC1=C(C(=O)C2=CC(=C(C(=C2O1)C)O)CN3CCCCC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H26N2O3S/c1-3-19-21(25-26-18-9-5-6-10-20(18)31-25)23(29)17-13-16(14-27-11-7-4-8-12-27)22(28)15(2)24(17)30-19/h5-6,9-10,13,28H,3-4,7-8,11-12,14H2,1-2H3