6-hexyl-3-(6-methylimidazo[2,1-b][1,3]benzothiazol-2-yl)-7-oxidanyl-chromen-2-one

Systemtic Name: 6-hexyl-3-(6-methylimidazo[2,1-b][1,3]benzothiazol-2-yl)-7-oxidanyl-chromen-2-one Openeye Name: 6-hexyl-7-hydroxy-3-(6-methylimidazo[2,1-b][1,3]benzothiazol-2-yl)chromen-2-one CAS Name: 6-hexyl-7-hydroxy-3-(6-methyl-2-imidazo[2,1-b][1,3]benzothiazolyl)-1-benzopyran-2-one IUPAC Name: 6-hexyl-7-hydroxy-3-(6-methylimidazo[2,1-b][1,3]benzothiazol-2-yl)chromen-2-one Traditional Name: 6-hexyl-7-hydroxy-3-(6-methylimidazo[2,1-b][1,3]benzothiazol-2-yl)coumarin Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=CN4C5=C(C=C(C=C5)C)SC4=N3)O

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=CN4C5=C(C=C(C=C5)C)SC4=N3)O

InChI

InChI=1S/C25H24N2O3S/c1-3-4-5-6-7-16-11-17-12-18(24(29)30-22(17)13-21(16)28)19-14-27-20-9-8-15(2)10-23(20)31-25(27)26-19/h8-14,28H,3-7H2,1-2H3