N-[(4-nitrophenyl)carbamothioyl]-2-[(3S,5S)-2-oxidanylidene-5-pentyl-oxolan-3-yl]ethanamide

Systemtic Name: N-[(4-nitrophenyl)carbamothioyl]-2-[(3S,5S)-2-oxidanylidene-5-pentyl-oxolan-3-yl]ethanamide Openeye Name: N-[(4-nitrophenyl)carbamothioyl]-2-[(3S,5S)-2-oxo-5-pentyl-tetrahydrofuran-3-yl]acetamide CAS Name: N-[(4-nitroanilino)-sulfanylidenemethyl]-2-[(3S,5S)-2-oxo-5-pentyl-3-oxolanyl]acetamide IUPAC Name: N-[(4-nitrophenyl)carbamothioyl]-2-[(3S,5S)-2-oxo-5-pentyloxolan-3-yl]acetamide Traditional Name: 2-[(3S,5S)-5-amyl-2-keto-tetrahydrofuran-3-yl]-N-[(4-nitrophenyl)thiocarbamoyl]acetamide Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC(C(=O)O1)CC(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCC[C@H]1C[C@H](C(=O)O1)CC(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O5S/c1-2-3-4-5-15-10-12(17(23)26-15)11-16(22)20-18(27)19-13-6-8-14(9-7-13)21(24)25/h6-9,12,15H,2-5,10-11H2,1H3,(H2,19,20,22,27)/t12-,15-/m0/s1