[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2,3,4-trimethoxyphenyl)methanone

Systemtic Name: [3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2,3,4-trimethoxyphenyl)methanone Openeye Name: [3-(1,3-benzothiazol-2-yl)-1-piperidyl]-(2,3,4-trimethoxyphenyl)methanone CAS Name: [3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(2,3,4-trimethoxyphenyl)methanone IUPAC Name: [3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2,3,4-trimethoxyphenyl)methanone Traditional Name: [3-(1,3-benzothiazol-2-yl)piperidino]-(2,3,4-trimethoxyphenyl)methanone Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3)OC)OC

InChI

InChI=1S/C22H24N2O4S/c1-26-17-11-10-15(19(27-2)20(17)28-3)22(25)24-12-6-7-14(13-24)21-23-16-8-4-5-9-18(16)29-21/h4-5,8-11,14H,6-7,12-13H2,1-3H3