3-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-4,8-dimethyl-7-oxidanyl-chromen-2-one

Systemtic Name: 3-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-4,8-dimethyl-7-oxidanyl-chromen-2-one Openeye Name: 3-[2-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-oxo-ethyl]-7-hydroxy-4,8-dimethyl-chromen-2-one CAS Name: 3-[2-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-oxoethyl]-7-hydroxy-4,8-dimethyl-1-benzopyran-2-one IUPAC Name: 3-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxoethyl]-7-hydroxy-4,8-dimethylchromen-2-one Traditional Name: 3-[2-[4-(1,3-benzothiazol-2-yl)piperidino]-2-keto-ethyl]-7-hydroxy-4,8-dimethyl-coumarin Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H24N2O4S/c1-14-17-7-8-20(28)15(2)23(17)31-25(30)18(14)13-22(29)27-11-9-16(10-12-27)24-26-19-5-3-4-6-21(19)32-24/h3-8,16,28H,9-13H2,1-2H3