N-(6-methoxy-2-phenylsulfanyl-pyridin-3-yl)-5-(propan-2-ylsulfonylamino)pentanamide

Systemtic Name: N-(6-methoxy-2-phenylsulfanyl-pyridin-3-yl)-5-(propan-2-ylsulfonylamino)pentanamide Openeye Name: 5-(isopropylsulfonylamino)-N-(6-methoxy-2-phenylsulfanyl-3-pyridyl)pentanamide CAS Name: N-[6-methoxy-2-(phenylthio)-3-pyridinyl]-5-(propan-2-ylsulfonylamino)pentanamide IUPAC Name: N-(6-methoxy-2-phenylsulfanylpyridin-3-yl)-5-(propan-2-ylsulfonylamino)pentanamide Traditional Name: 5-(isopropylsulfonylamino)-N-[6-methoxy-2-(phenylthio)-3-pyridyl]valeramide Formula: C20H27N3O4S2 MolecularWeight: 437.57608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NCCCCC(=O)NC1=C(N=C(C=C1)OC)SC2=CC=CC=C2

Isomeric SMILES

CC(C)S(=O)(=O)NCCCCC(=O)NC1=C(N=C(C=C1)OC)SC2=CC=CC=C2

InChI

InChI=1S/C20H27N3O4S2/c1-15(2)29(25,26)21-14-8-7-11-18(24)22-17-12-13-19(27-3)23-20(17)28-16-9-5-4-6-10-16/h4-6,9-10,12-13,15,21H,7-8,11,14H2,1-3H3,(H,22,24)