N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylsulfanyl-N-[(E)-3-phenylprop-2-enyl]pyridine-3-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylsulfanyl-N-[(E)-3-phenylprop-2-enyl]pyridine-3-carboxamide Openeye Name: N-[(E)-cinnamyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(methylthio)-N-[(E)-3-phenylprop-2-enyl]-3-pyridinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylsulfanyl-N-[(E)-3-phenylprop-2-enyl]pyridine-3-carboxamide Traditional Name: N-[(E)-cinnamyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(methylthio)nicotinamide Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)N(CC=CC2=CC=CC=C2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)N(C/C=C/C2=CC=CC=C2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C24H22N2O3S/c1-30-23-20(10-5-13-25-23)24(27)26(14-6-9-18-7-3-2-4-8-18)19-11-12-21-22(17-19)29-16-15-28-21/h2-13,17H,14-16H2,1H3/b9-6+