N-[[3-(hydroxymethyl)phenyl]carbamothioyl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[[3-(hydroxymethyl)phenyl]carbamothioyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[[3-(hydroxymethyl)phenyl]carbamothioyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[[3-(hydroxymethyl)anilino]-sulfanylidenemethyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[[3-(hydroxymethyl)phenyl]carbamothioyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[(3-methylolphenyl)thiocarbamoyl]-2-(4-nitrophenoxy)acetamide Formula: C16H15N3O5S MolecularWeight: 361.3724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])CO

Isomeric SMILES

C1=CC(=CC(=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])CO

InChI

InChI=1S/C16H15N3O5S/c20-9-11-2-1-3-12(8-11)17-16(25)18-15(21)10-24-14-6-4-13(5-7-14)19(22)23/h1-8,20H,9-10H2,(H2,17,18,21,25)