5-bromanyl-N-[(4-hexoxyphenyl)carbamothioyl]-2-(2-methylpropoxy)benzamide

Systemtic Name: 5-bromanyl-N-[(4-hexoxyphenyl)carbamothioyl]-2-(2-methylpropoxy)benzamide Openeye Name: 5-bromo-N-[(4-hexoxyphenyl)carbamothioyl]-2-isobutoxy-benzamide CAS Name: 5-bromo-N-[(4-hexoxyanilino)-sulfanylidenemethyl]-2-(2-methylpropoxy)benzamide IUPAC Name: 5-bromo-N-[(4-hexoxyphenyl)carbamothioyl]-2-(2-methylpropoxy)benzamide Traditional Name: 5-bromo-N-[(4-hexoxyphenyl)thiocarbamoyl]-2-isobutoxy-benzamide Formula: C24H31BrN2O3S MolecularWeight: 507.48354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCC(C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCC(C)C

InChI

InChI=1S/C24H31BrN2O3S/c1-4-5-6-7-14-29-20-11-9-19(10-12-20)26-24(31)27-23(28)21-15-18(25)8-13-22(21)30-16-17(2)3/h8-13,15,17H,4-7,14,16H2,1-3H3,(H2,26,27,28,31)