2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[2-(2-furyl)-2-(1-piperidyl)ethyl]acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[2-(2-furanyl)-2-(1-piperidinyl)ethyl]acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[2-(2-furyl)-2-piperidino-ethyl]acetamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CNC(=O)CSC2=CC3=C(C=C2)OCCO3)C4=CC=CO4

Isomeric SMILES

C1CCN(CC1)C(CNC(=O)CSC2=CC3=C(C=C2)OCCO3)C4=CC=CO4

InChI

InChI=1S/C21H26N2O4S/c24-21(15-28-16-6-7-19-20(13-16)27-12-11-26-19)22-14-17(18-5-4-10-25-18)23-8-2-1-3-9-23/h4-7,10,13,17H,1-3,8-9,11-12,14-15H2,(H,22,24)