4-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[[4-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[[4-(1,3-benzothiazol-2-yl)piperidino]methyl]-6,7-dimethyl-coumarin Formula: C24H24N2O2S MolecularWeight: 404.52456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3CCC(CC3)C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3CCC(CC3)C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C24H24N2O2S/c1-15-11-19-18(13-23(27)28-21(19)12-16(15)2)14-26-9-7-17(8-10-26)24-25-20-5-3-4-6-22(20)29-24/h3-6,11-13,17H,7-10,14H2,1-2H3