3-[(2-methylpropan-2-yl)oxy]-4-[(4-pyridin-4-yloxyphenyl)sulfanylmethyl]oxane-2-carboxamide

Systemtic Name: 3-[(2-methylpropan-2-yl)oxy]-4-[(4-pyridin-4-yloxyphenyl)sulfanylmethyl]oxane-2-carboxamide Openeye Name: 3-tert-butoxy-4-[[4-(4-pyridyloxy)phenyl]sulfanylmethyl]tetrahydropyran-2-carboxamide CAS Name: 3-[(2-methylpropan-2-yl)oxy]-4-[[(4-pyridin-4-yloxyphenyl)thio]methyl]-2-oxanecarboxamide IUPAC Name: 3-[(2-methylpropan-2-yl)oxy]-4-[(4-pyridin-4-yloxyphenyl)sulfanylmethyl]oxane-2-carboxamide Traditional Name: 3-tert-butoxy-4-[[[4-(4-pyridyloxy)phenyl]thio]methyl]tetrahydropyran-2-carboxamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1C(CCOC1C(=O)N)CSC2=CC=C(C=C2)OC3=CC=NC=C3

Isomeric SMILES

CC(C)(C)OC1C(CCOC1C(=O)N)CSC2=CC=C(C=C2)OC3=CC=NC=C3

InChI

InChI=1S/C22H28N2O4S/c1-22(2,3)28-19-15(10-13-26-20(19)21(23)25)14-29-18-6-4-16(5-7-18)27-17-8-11-24-12-9-17/h4-9,11-12,15,19-20H,10,13-14H2,1-3H3,(H2,23,25)