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

Systemtic Name: 3-bromanyl-N-[(4-ethoxyphenyl)carbamothioyl]-4-(2-methylpropoxy)benzamide Openeye Name: 3-bromo-N-[(4-ethoxyphenyl)carbamothioyl]-4-isobutoxy-benzamide CAS Name: 3-bromo-N-[(4-ethoxyanilino)-sulfanylidenemethyl]-4-(2-methylpropoxy)benzamide IUPAC Name: 3-bromo-N-[(4-ethoxyphenyl)carbamothioyl]-4-(2-methylpropoxy)benzamide Traditional Name: 3-bromo-4-isobutoxy-N-(p-phenetylthiocarbamoyl)benzamide Formula: C20H23BrN2O3S MolecularWeight: 451.37722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC(C)C)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC(C)C)Br

InChI

InChI=1S/C20H23BrN2O3S/c1-4-25-16-8-6-15(7-9-16)22-20(27)23-19(24)14-5-10-18(17(21)11-14)26-12-13(2)3/h5-11,13H,4,12H2,1-3H3,(H2,22,23,24,27)