N-[(3-bromophenyl)carbamothioyl]-4-pentoxy-benzamide

Systemtic Name: N-[(3-bromophenyl)carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[(3-bromophenyl)carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[(3-bromoanilino)-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[(3-bromophenyl)carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[(3-bromophenyl)thiocarbamoyl]benzamide Formula: C19H21BrN2O2S MolecularWeight: 421.35124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C19H21BrN2O2S/c1-2-3-4-12-24-17-10-8-14(9-11-17)18(23)22-19(25)21-16-7-5-6-15(20)13-16/h5-11,13H,2-4,12H2,1H3,(H2,21,22,23,25)