2-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole

Systemtic Name: 2-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole Openeye Name: 2-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidyl]-1,3-benzothiazole CAS Name: 2-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinyl]-1,3-benzothiazole IUPAC Name: 2-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole Traditional Name: 2-(1-mesitylsulfonyl-4-piperidyl)-1,3-benzothiazole Formula: C21H24N2O2S2 MolecularWeight: 400.55746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C21H24N2O2S2/c1-14-12-15(2)20(16(3)13-14)27(24,25)23-10-8-17(9-11-23)21-22-18-6-4-5-7-19(18)26-21/h4-7,12-13,17H,8-11H2,1-3H3