1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(phenylmethylsulfanyl)ethyl]cyclopentane-1-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(phenylmethylsulfanyl)ethyl]cyclopentane-1-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentanecarboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(phenylmethylthio)ethyl]-1-cyclopentanecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentane-1-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentanecarboxamide Formula: C23H27NO3S MolecularWeight: 397.53038

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC3=C(C=C2)OCCO3)C(=O)NCCSCC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)(C2=CC3=C(C=C2)OCCO3)C(=O)NCCSCC4=CC=CC=C4

InChI

InChI=1S/C23H27NO3S/c25-22(24-12-15-28-17-18-6-2-1-3-7-18)23(10-4-5-11-23)19-8-9-20-21(16-19)27-14-13-26-20/h1-3,6-9,16H,4-5,10-15,17H2,(H,24,25)