N-[[(2R)-oxolan-2-yl]methyl]-3-(propanoylcarbamothioylamino)benzamide

Systemtic Name: N-[[(2R)-oxolan-2-yl]methyl]-3-(propanoylcarbamothioylamino)benzamide Openeye Name: 3-(propanoylcarbamothioylamino)-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide CAS Name: N-[[(2R)-2-oxolanyl]methyl]-3-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-[[(2R)-oxolan-2-yl]methyl]-3-(propanoylcarbamothioylamino)benzamide Traditional Name: 3-(propionylthiocarbamoylamino)-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)NCC2CCCO2

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)NC[C@H]2CCCO2

InChI

InChI=1S/C16H21N3O3S/c1-2-14(20)19-16(23)18-12-6-3-5-11(9-12)15(21)17-10-13-7-4-8-22-13/h3,5-6,9,13H,2,4,7-8,10H2,1H3,(H,17,21)(H2,18,19,20,23)/t13-/m1/s1