3-bromanyl-4-ethoxy-N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[(2-ethyl-6-methylphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[(2-ethyl-6-methyl-phenyl)thiocarbamoyl]benzamide Formula: C19H21BrN2O2S MolecularWeight: 421.35124

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)Br)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)Br)C

InChI

InChI=1S/C19H21BrN2O2S/c1-4-13-8-6-7-12(3)17(13)21-19(25)22-18(23)14-9-10-16(24-5-2)15(20)11-14/h6-11H,4-5H2,1-3H3,(H2,21,22,23,25)