N-[(4-nitrophenyl)carbamothioyl]-2-[5-oxidanylidene-4-(propan-2-yloxymethyl)oxolan-2-yl]ethanamide

Systemtic Name: N-[(4-nitrophenyl)carbamothioyl]-2-[5-oxidanylidene-4-(propan-2-yloxymethyl)oxolan-2-yl]ethanamide Openeye Name: 2-[4-(isopropoxymethyl)-5-oxo-tetrahydrofuran-2-yl]-N-[(4-nitrophenyl)carbamothioyl]acetamide CAS Name: N-[(4-nitroanilino)-sulfanylidenemethyl]-2-[5-oxo-4-(propan-2-yloxymethyl)-2-oxolanyl]acetamide IUPAC Name: N-[(4-nitrophenyl)carbamothioyl]-2-[5-oxo-4-(propan-2-yloxymethyl)oxolan-2-yl]acetamide Traditional Name: 2-[4-(isopropoxymethyl)-5-keto-tetrahydrofuran-2-yl]-N-[(4-nitrophenyl)thiocarbamoyl]acetamide Formula: C17H21N3O6S MolecularWeight: 395.43014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1CC(OC1=O)CC(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)OCC1CC(OC1=O)CC(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O6S/c1-10(2)25-9-11-7-14(26-16(11)22)8-15(21)19-17(27)18-12-3-5-13(6-4-12)20(23)24/h3-6,10-11,14H,7-9H2,1-2H3,(H2,18,19,21,27)