1-[2-[2-(1,3-benzodioxol-5-yl)ethanoyl]pyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one

Systemtic Name: 1-[2-[2-(1,3-benzodioxol-5-yl)ethanoyl]pyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one Openeye Name: 1-[2-[2-(1,3-benzodioxol-5-yl)acetyl]pyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one CAS Name: 1-[2-[2-(1,3-benzodioxol-5-yl)-1-oxoethyl]-1-pyrazolidinyl]-3-(methylthio)-1-propanone IUPAC Name: 1-[2-[2-(1,3-benzodioxol-5-yl)acetyl]pyrazolidin-1-yl]-3-methylsulfanylpropan-1-one Traditional Name: 1-[2-[2-(1,3-benzodioxol-5-yl)acetyl]pyrazolidin-1-yl]-3-(methylthio)propan-1-one Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)N1CCCN1C(=O)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CSCCC(=O)N1CCCN1C(=O)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H20N2O4S/c1-23-8-5-15(19)17-6-2-7-18(17)16(20)10-12-3-4-13-14(9-12)22-11-21-13/h3-4,9H,2,5-8,10-11H2,1H3