3-bromanyl-4-methoxy-N-[(phenylmethyl)-propyl-carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-methoxy-N-[(phenylmethyl)-propyl-carbamothioyl]benzamide Openeye Name: N-[benzyl(propyl)carbamothioyl]-3-bromo-4-methoxy-benzamide CAS Name: 3-bromo-4-methoxy-N-[[(phenylmethyl)-propylamino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[benzyl(propyl)carbamothioyl]-3-bromo-4-methoxybenzamide Traditional Name: N-[benzyl(propyl)thiocarbamoyl]-3-bromo-4-methoxy-benzamide Formula: C19H21BrN2O2S MolecularWeight: 421.35124

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C19H21BrN2O2S/c1-3-11-22(13-14-7-5-4-6-8-14)19(25)21-18(23)15-9-10-17(24-2)16(20)12-15/h4-10,12H,3,11,13H2,1-2H3,(H,21,23,25)