N-(1-phenylethyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(1-phenylethyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propanamide Openeye Name: N-(1-phenylethyl)-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-(1-phenylethyl)-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-(1-phenylethyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanamide Traditional Name: N-(1-phenylethyl)-2-[(5-piperidinosulfonyl-2-pyridyl)thio]propionamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H27N3O3S2/c1-16(18-9-5-3-6-10-18)23-21(25)17(2)28-20-12-11-19(15-22-20)29(26,27)24-13-7-4-8-14-24/h3,5-6,9-12,15-17H,4,7-8,13-14H2,1-2H3,(H,23,25)