3-chloranyl-4-methyl-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-4-methyl-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-4-methyl-N-[1-(p-tolylsulfonyl)-4-piperidyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-4-methyl-N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-4-methyl-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-4-methyl-N-(1-tosyl-4-piperidyl)benzothiophene-2-carboxamide Formula: C22H23ClN2O3S2 MolecularWeight: 463.01262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=C(C4=C(C=CC=C4S3)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=C(C4=C(C=CC=C4S3)C)Cl

InChI

InChI=1S/C22H23ClN2O3S2/c1-14-6-8-17(9-7-14)30(27,28)25-12-10-16(11-13-25)24-22(26)21-20(23)19-15(2)4-3-5-18(19)29-21/h3-9,16H,10-13H2,1-2H3,(H,24,26)