N-[ethyl(oxolan-2-ylmethyl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[ethyl(oxolan-2-ylmethyl)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[ethyl(tetrahydrofuran-2-ylmethyl)carbamothioyl]-3-nitro-benzamide CAS Name: N-[[ethyl(2-oxolanylmethyl)amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[ethyl(oxolan-2-ylmethyl)carbamothioyl]-3-nitrobenzamide Traditional Name: N-[ethyl(tetrahydrofurfuryl)thiocarbamoyl]-3-nitro-benzamide Formula: C15H19N3O4S MolecularWeight: 337.39406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CCCO1)C(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1CCCO1)C(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O4S/c1-2-17(10-13-7-4-8-22-13)15(23)16-14(19)11-5-3-6-12(9-11)18(20)21/h3,5-6,9,13H,2,4,7-8,10H2,1H3,(H,16,19,23)