2-[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole

Systemtic Name: 2-[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole Openeye Name: 2-[1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidyl]-1,3-benzothiazole CAS Name: 2-[1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidinyl]-1,3-benzothiazole IUPAC Name: 2-[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole Traditional Name: 2-[1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidyl]-1,3-benzothiazole Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4S2/c1-25-17-8-7-15(13-18(17)26-2)28(23,24)22-11-9-14(10-12-22)20-21-16-5-3-4-6-19(16)27-20/h3-8,13-14H,9-12H2,1-2H3