N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-2-methylsulfanyl-benzamide

Systemtic Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-2-methylsulfanyl-benzamide Openeye Name: N-[2-(diethylamino)-5-(1-piperidylsulfonyl)phenyl]-2-methylsulfanyl-benzamide CAS Name: N-[2-(diethylamino)-5-(1-piperidinylsulfonyl)phenyl]-2-(methylthio)benzamide IUPAC Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonylphenyl]-2-methylsulfanylbenzamide Traditional Name: N-[2-(diethylamino)-5-piperidinosulfonyl-phenyl]-2-(methylthio)benzamide Formula: C23H31N3O3S2 MolecularWeight: 461.64054

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=CC=C3SC

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=CC=C3SC

InChI

InChI=1S/C23H31N3O3S2/c1-4-25(5-2)21-14-13-18(31(28,29)26-15-9-6-10-16-26)17-20(21)24-23(27)19-11-7-8-12-22(19)30-3/h7-8,11-14,17H,4-6,9-10,15-16H2,1-3H3,(H,24,27)