[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-chloranyl-4,5-dimethoxy-phenyl)methanone

Systemtic Name: [3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-chloranyl-4,5-dimethoxy-phenyl)methanone Openeye Name: [3-(1,3-benzothiazol-2-yl)-1-piperidyl]-(3-chloro-4,5-dimethoxy-phenyl)methanone CAS Name: [3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(3-chloro-4,5-dimethoxyphenyl)methanone IUPAC Name: [3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-chloro-4,5-dimethoxyphenyl)methanone Traditional Name: [3-(1,3-benzothiazol-2-yl)piperidino]-(3-chloro-4,5-dimethoxy-phenyl)methanone Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O3S/c1-26-17-11-14(10-15(22)19(17)27-2)21(25)24-9-5-6-13(12-24)20-23-16-7-3-4-8-18(16)28-20/h3-4,7-8,10-11,13H,5-6,9,12H2,1-2H3