2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[(4-methylphenyl)-thiophen-2-yl-methyl]ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[(4-methylphenyl)-thiophen-2-yl-methyl]ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[p-tolyl(2-thienyl)methyl]acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[p-tolyl(2-thienyl)methyl]acetamide Formula: C22H21NO3S2 MolecularWeight: 411.53704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H21NO3S2/c1-15-4-6-16(7-5-15)22(20-3-2-12-27-20)23-21(24)14-28-17-8-9-18-19(13-17)26-11-10-25-18/h2-9,12-13,22H,10-11,14H2,1H3,(H,23,24)