3-methyl-N-(2-oxidanylideneoxolan-3-yl)-2-(phenylcarbamothioylamino)pentanamide

Systemtic Name: 3-methyl-N-(2-oxidanylideneoxolan-3-yl)-2-(phenylcarbamothioylamino)pentanamide Openeye Name: 3-methyl-N-(2-oxotetrahydrofuran-3-yl)-2-(phenylcarbamothioylamino)pentanamide CAS Name: 2-[[anilino(sulfanylidene)methyl]amino]-3-methyl-N-(2-oxo-3-oxolanyl)pentanamide IUPAC Name: 3-methyl-N-(2-oxooxolan-3-yl)-2-(phenylcarbamothioylamino)pentanamide Traditional Name: N-(2-ketotetrahydrofuran-3-yl)-3-methyl-2-(phenylthiocarbamoylamino)valeramide Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1CCOC1=O)NC(=S)NC2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)NC1CCOC1=O)NC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C17H23N3O3S/c1-3-11(2)14(15(21)19-13-9-10-23-16(13)22)20-17(24)18-12-7-5-4-6-8-12/h4-8,11,13-14H,3,9-10H2,1-2H3,(H,19,21)(H2,18,20,24)