3-nitro-N-[(phenylmethyl)-propyl-carbamothioyl]benzamide

Systemtic Name: 3-nitro-N-[(phenylmethyl)-propyl-carbamothioyl]benzamide Openeye Name: N-[benzyl(propyl)carbamothioyl]-3-nitro-benzamide CAS Name: 3-nitro-N-[[(phenylmethyl)-propylamino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[benzyl(propyl)carbamothioyl]-3-nitrobenzamide Traditional Name: N-[benzyl(propyl)thiocarbamoyl]-3-nitro-benzamide Formula: C18H19N3O3S MolecularWeight: 357.42676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3S/c1-2-11-20(13-14-7-4-3-5-8-14)18(25)19-17(22)15-9-6-10-16(12-15)21(23)24/h3-10,12H,2,11,13H2,1H3,(H,19,22,25)