N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(diphenylmethyl)sulfanyl-ethanamide

Systemtic Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(diphenylmethyl)sulfanyl-ethanamide Openeye Name: 2-benzhydrylsulfanyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide CAS Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[(diphenylmethyl)thio]acetamide IUPAC Name: 2-benzhydrylsulfanyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide Traditional Name: 2-(benzhydrylthio)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide Formula: C25H25NO3S MolecularWeight: 419.5359

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCNC(=O)CSC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCNC(=O)CSC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H25NO3S/c27-24(26-14-13-19-11-12-22-23(17-19)29-16-15-28-22)18-30-25(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,17,25H,13-16,18H2,(H,26,27)