N-(1,3-benzodioxol-5-yl)-4-[(2R)-oxolan-2-yl]carbonyl-piperazine-1-carbothioamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-[(2R)-oxolan-2-yl]carbonyl-piperazine-1-carbothioamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-[(2R)-tetrahydrofuran-2-carbonyl]piperazine-1-carbothioamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-[oxo-[(2R)-2-oxolanyl]methyl]-1-piperazinecarbothioamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-[(2R)-oxolane-2-carbonyl]piperazine-1-carbothioamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-[(2R)-tetrahydrofuran-2-carbonyl]piperazine-1-carbothioamide Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)N2CCN(CC2)C(=S)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C[C@@H](OC1)C(=O)N2CCN(CC2)C(=S)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H21N3O4S/c21-16(14-2-1-9-22-14)19-5-7-20(8-6-19)17(25)18-12-3-4-13-15(10-12)24-11-23-13/h3-4,10,14H,1-2,5-9,11H2,(H,18,25)/t14-/m1/s1