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

Systemtic Name: 3-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]-4,7-dimethyl-chromen-2-one Openeye Name: 3-[3-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-oxo-propyl]-4,7-dimethyl-chromen-2-one CAS Name: 3-[3-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-oxopropyl]-4,7-dimethyl-1-benzopyran-2-one IUPAC Name: 3-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxopropyl]-4,7-dimethylchromen-2-one Traditional Name: 3-[3-[4-(1,3-benzothiazol-2-yl)piperidino]-3-keto-propyl]-4,7-dimethyl-coumarin Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C26H26N2O3S/c1-16-7-8-19-17(2)20(26(30)31-22(19)15-16)9-10-24(29)28-13-11-18(12-14-28)25-27-21-5-3-4-6-23(21)32-25/h3-8,15,18H,9-14H2,1-2H3