N,N-diethyl-4-[2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N,N-diethyl-4-[2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N,N-diethyl-4-[[2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]acetyl]amino]benzamide CAS Name: N,N-diethyl-4-[[1-oxo-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]ethyl]amino]benzamide IUPAC Name: N,N-diethyl-4-[[2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N,N-diethyl-4-[[2-[(5-piperidinosulfonyl-2-pyridyl)thio]acetyl]amino]benzamide Formula: C23H30N4O4S2 MolecularWeight: 490.6387

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H30N4O4S2/c1-3-26(4-2)23(29)18-8-10-19(11-9-18)25-21(28)17-32-22-13-12-20(16-24-22)33(30,31)27-14-6-5-7-15-27/h8-13,16H,3-7,14-15,17H2,1-2H3,(H,25,28)