1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(3,4-dimethoxyphenyl)ethanone

Systemtic Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(3,4-dimethoxyphenyl)ethanone Openeye Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-(3,4-dimethoxyphenyl)ethanone CAS Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-(3,4-dimethoxyphenyl)ethanone IUPAC Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(3,4-dimethoxyphenyl)ethanone Traditional Name: 1-[4-(1,3-benzothiazol-2-yl)piperidino]-2-(3,4-dimethoxyphenyl)ethanone Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C22H24N2O3S/c1-26-18-8-7-15(13-19(18)27-2)14-21(25)24-11-9-16(10-12-24)22-23-17-5-3-4-6-20(17)28-22/h3-8,13,16H,9-12,14H2,1-2H3