5-bromanyl-N-[methyl-(phenylmethyl)carbamothioyl]-2-propoxy-benzamide

Systemtic Name: 5-bromanyl-N-[methyl-(phenylmethyl)carbamothioyl]-2-propoxy-benzamide Openeye Name: N-[benzyl(methyl)carbamothioyl]-5-bromo-2-propoxy-benzamide CAS Name: 5-bromo-N-[[methyl-(phenylmethyl)amino]-sulfanylidenemethyl]-2-propoxybenzamide IUPAC Name: N-[benzyl(methyl)carbamothioyl]-5-bromo-2-propoxybenzamide Traditional Name: N-[benzyl(methyl)thiocarbamoyl]-5-bromo-2-propoxy-benzamide Formula: C19H21BrN2O2S MolecularWeight: 421.35124

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)N(C)CC2=CC=CC=C2

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)N(C)CC2=CC=CC=C2

InChI

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