N-[(4-acetamidophenyl)carbamothioyl]-3-bromanyl-4-(2-methylpropoxy)benzamide

Systemtic Name: N-[(4-acetamidophenyl)carbamothioyl]-3-bromanyl-4-(2-methylpropoxy)benzamide Openeye Name: N-[(4-acetamidophenyl)carbamothioyl]-3-bromo-4-isobutoxy-benzamide CAS Name: N-[(4-acetamidoanilino)-sulfanylidenemethyl]-3-bromo-4-(2-methylpropoxy)benzamide IUPAC Name: N-[(4-acetamidophenyl)carbamothioyl]-3-bromo-4-(2-methylpropoxy)benzamide Traditional Name: N-[(4-acetamidophenyl)thiocarbamoyl]-3-bromo-4-isobutoxy-benzamide Formula: C20H22BrN3O3S MolecularWeight: 464.37598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C)Br

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C)Br

InChI

InChI=1S/C20H22BrN3O3S/c1-12(2)11-27-18-9-4-14(10-17(18)21)19(26)24-20(28)23-16-7-5-15(6-8-16)22-13(3)25/h4-10,12H,11H2,1-3H3,(H,22,25)(H2,23,24,26,28)