N-[(4-acetamidophenyl)carbamothioyl]-5-bromanyl-2-phenethyloxy-benzamide

Systemtic Name: N-[(4-acetamidophenyl)carbamothioyl]-5-bromanyl-2-phenethyloxy-benzamide Openeye Name: N-[(4-acetamidophenyl)carbamothioyl]-5-bromo-2-phenethyloxy-benzamide CAS Name: N-[(4-acetamidoanilino)-sulfanylidenemethyl]-5-bromo-2-phenethyloxybenzamide IUPAC Name: N-[(4-acetamidophenyl)carbamothioyl]-5-bromo-2-phenethyloxybenzamide Traditional Name: N-[(4-acetamidophenyl)thiocarbamoyl]-5-bromo-2-phenethyloxy-benzamide Formula: C24H22BrN3O3S MolecularWeight: 512.41878

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

InChI

InChI=1S/C24H22BrN3O3S/c1-16(29)26-19-8-10-20(11-9-19)27-24(32)28-23(30)21-15-18(25)7-12-22(21)31-14-13-17-5-3-2-4-6-17/h2-12,15H,13-14H2,1H3,(H,26,29)(H2,27,28,30,32)