N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-[[2-(4-methylanilino)-2-oxoethyl]thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-[[2-keto-2-(p-toluidino)ethyl]thio]acetamide Formula: C20H22N2O4S MolecularWeight: 386.46468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NCC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H22N2O4S/c1-14-2-5-16(6-3-14)22-20(24)13-27-12-19(23)21-11-15-4-7-17-18(10-15)26-9-8-25-17/h2-7,10H,8-9,11-13H2,1H3,(H,21,23)(H,22,24)