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

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-2-ethyl-6-[(2-ethylpiperidin-1-yl)methyl]-8-methyl-7-oxidanyl-chromen-4-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-2-ethyl-6-[(2-ethyl-1-piperidyl)methyl]-7-hydroxy-8-methyl-chromen-4-one CAS Name: 3-(1,3-benzothiazol-2-yl)-2-ethyl-6-[(2-ethyl-1-piperidinyl)methyl]-7-hydroxy-8-methyl-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-2-ethyl-6-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-8-methylchromen-4-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-2-ethyl-6-[(2-ethylpiperidino)methyl]-7-hydroxy-8-methyl-chromone Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CC2=C(C(=C3C(=C2)C(=O)C(=C(O3)CC)C4=NC5=CC=CC=C5S4)C)O

Isomeric SMILES

CCC1CCCCN1CC2=C(C(=C3C(=C2)C(=O)C(=C(O3)CC)C4=NC5=CC=CC=C5S4)C)O

InChI

InChI=1S/C27H30N2O3S/c1-4-18-10-8-9-13-29(18)15-17-14-19-25(31)23(21(5-2)32-26(19)16(3)24(17)30)27-28-20-11-6-7-12-22(20)33-27/h6-7,11-12,14,18,30H,4-5,8-10,13,15H2,1-3H3