N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-(phenylmethyl)-2-pyridin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-(phenylmethyl)-2-pyridin-4-ylsulfanyl-ethanamide Openeye Name: N-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(4-pyridylsulfanyl)acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-(phenylmethyl)-2-(pyridin-4-ylthio)acetamide IUPAC Name: N-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-pyridin-4-ylsulfanylacetamide Traditional Name: N-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(4-pyridylthio)acetamide Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CN(CC3=CC=CC=C3)C(=O)CSC4=CC=NC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CN(CC3=CC=CC=C3)C(=O)CSC4=CC=NC=C4

InChI

InChI=1S/C23H22N2O3S/c26-23(17-29-20-8-10-24-11-9-20)25(15-18-4-2-1-3-5-18)16-19-6-7-21-22(14-19)28-13-12-27-21/h1-11,14H,12-13,15-17H2