5-bromanyl-2-ethoxy-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-ethoxy-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-5-bromo-2-ethoxy-benzamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-5-bromo-2-ethoxybenzamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-5-bromo-2-ethoxybenzamide Traditional Name: N-[(4-anilinophenyl)thiocarbamoyl]-5-bromo-2-ethoxy-benzamide Formula: C22H20BrN3O2S MolecularWeight: 470.3821

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3

InChI

InChI=1S/C22H20BrN3O2S/c1-2-28-20-13-8-15(23)14-19(20)21(27)26-22(29)25-18-11-9-17(10-12-18)24-16-6-4-3-5-7-16/h3-14,24H,2H2,1H3,(H2,25,26,27,29)