N-(phenylmethyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-propan-2-yl-ethanamide

Systemtic Name: N-(phenylmethyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-propan-2-yl-ethanamide Openeye Name: N-benzyl-N-isopropyl-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(phenylmethyl)-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]-N-propan-2-ylacetamide IUPAC Name: N-benzyl-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-propan-2-ylacetamide Traditional Name: N-benzyl-N-isopropyl-2-[(5-piperidinosulfonyl-2-pyridyl)thio]acetamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H29N3O3S2/c1-18(2)25(16-19-9-5-3-6-10-19)22(26)17-29-21-12-11-20(15-23-21)30(27,28)24-13-7-4-8-14-24/h3,5-6,9-12,15,18H,4,7-8,13-14,16-17H2,1-2H3