5-chloranyl-2-[1-(4-methylsulfonylphenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole

Systemtic Name: 5-chloranyl-2-[1-(4-methylsulfonylphenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole Openeye Name: 5-chloro-2-[1-(4-methylsulfonylphenyl)sulfonyl-4-piperidyl]-1,3-benzothiazole CAS Name: 5-chloro-2-[1-(4-methylsulfonylphenyl)sulfonyl-4-piperidinyl]-1,3-benzothiazole IUPAC Name: 5-chloro-2-[1-(4-methylsulfonylphenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole Traditional Name: 5-chloro-2-[1-(4-mesylphenyl)sulfonyl-4-piperidyl]-1,3-benzothiazole Formula: C19H19ClN2O4S3 MolecularWeight: 471.01316

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C19H19ClN2O4S3/c1-28(23,24)15-3-5-16(6-4-15)29(25,26)22-10-8-13(9-11-22)19-21-17-12-14(20)2-7-18(17)27-19/h2-7,12-13H,8-11H2,1H3