N-(2-cyanoethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(4-methylphenyl)ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(4-methylphenyl)ethanamide Openeye Name: N-(2-cyanoethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(p-tolyl)acetamide CAS Name: N-(2-cyanoethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(4-methylphenyl)acetamide IUPAC Name: N-(2-cyanoethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(4-methylphenyl)acetamide Traditional Name: N-(2-cyanoethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(p-tolyl)acetamide Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H20N2O3S/c1-15-3-5-16(6-4-15)22(10-2-9-21)20(23)14-26-17-7-8-18-19(13-17)25-12-11-24-18/h3-8,13H,2,10-12,14H2,1H3