1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-(2-methoxy-5-methyl-phenyl)butane-1,4-dione

Systemtic Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-(2-methoxy-5-methyl-phenyl)butane-1,4-dione Openeye Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-4-(2-methoxy-5-methyl-phenyl)butane-1,4-dione CAS Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-4-(2-methoxy-5-methylphenyl)butane-1,4-dione IUPAC Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-(2-methoxy-5-methylphenyl)butane-1,4-dione Traditional Name: 1-[4-(1,3-benzothiazol-2-yl)piperidino]-4-(2-methoxy-5-methyl-phenyl)butane-1,4-dione Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(=O)CCC(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)CCC(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H26N2O3S/c1-16-7-9-21(29-2)18(15-16)20(27)8-10-23(28)26-13-11-17(12-14-26)24-25-19-5-3-4-6-22(19)30-24/h3-7,9,15,17H,8,10-14H2,1-2H3