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

Systemtic Name: 2-[1-(3,4-dimethylphenyl)sulfonylpiperidin-2-yl]-1,3-benzothiazole Openeye Name: 2-[1-(3,4-dimethylphenyl)sulfonyl-2-piperidyl]-1,3-benzothiazole CAS Name: 2-[1-(3,4-dimethylphenyl)sulfonyl-2-piperidinyl]-1,3-benzothiazole IUPAC Name: 2-[1-(3,4-dimethylphenyl)sulfonylpiperidin-2-yl]-1,3-benzothiazole Traditional Name: 2-[1-(3,4-dimethylphenyl)sulfonyl-2-piperidyl]-1,3-benzothiazole Formula: C20H22N2O2S2 MolecularWeight: 386.53088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C20H22N2O2S2/c1-14-10-11-16(13-15(14)2)26(23,24)22-12-6-5-8-18(22)20-21-17-7-3-4-9-19(17)25-20/h3-4,7,9-11,13,18H,5-6,8,12H2,1-2H3