2-[2-(1,3-benzodioxol-5-yl)ethanoyl]-N-(3-methoxypropyl)pyrazolidine-1-carbothioamide

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)ethanoyl]-N-(3-methoxypropyl)pyrazolidine-1-carbothioamide Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)acetyl]-N-(3-methoxypropyl)pyrazolidine-1-carbothioamide CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-1-oxoethyl]-N-(3-methoxypropyl)-1-pyrazolidinecarbothioamide IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)acetyl]-N-(3-methoxypropyl)pyrazolidine-1-carbothioamide Traditional Name: 2-[2-(1,3-benzodioxol-5-yl)acetyl]-N-(3-methoxypropyl)pyrazolidine-1-carbothioamide Formula: C17H23N3O4S MolecularWeight: 365.44722

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)N1CCCN1C(=O)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COCCCNC(=S)N1CCCN1C(=O)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H23N3O4S/c1-22-9-2-6-18-17(25)20-8-3-7-19(20)16(21)11-13-4-5-14-15(10-13)24-12-23-14/h4-5,10H,2-3,6-9,11-12H2,1H3,(H,18,25)