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

Systemtic Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(4-methylphenyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-phenyl-N-(p-tolyl)acetamide CAS Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(4-methylphenyl)-2-phenylacetamide IUPAC Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(4-methylphenyl)-2-phenylacetamide Traditional Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-2-phenyl-N-(p-tolyl)acetamide Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](C2=CC=CC=C2)SC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H21NO3S/c1-16-7-9-18(10-8-16)24-23(25)22(17-5-3-2-4-6-17)28-19-11-12-20-21(15-19)27-14-13-26-20/h2-12,15,22H,13-14H2,1H3,(H,24,25)/t22-/m0/s1