5-bromanyl-2-(3-methylbutoxy)-N-[(4-methylphenyl)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-(3-methylbutoxy)-N-[(4-methylphenyl)carbamothioyl]benzamide Openeye Name: 5-bromo-2-isopentyloxy-N-(p-tolylcarbamothioyl)benzamide CAS Name: 5-bromo-N-[(4-methylanilino)-sulfanylidenemethyl]-2-(3-methylbutoxy)benzamide IUPAC Name: 5-bromo-2-(3-methylbutoxy)-N-[(4-methylphenyl)carbamothioyl]benzamide Traditional Name: 5-bromo-2-isoamoxy-N-(p-tolylthiocarbamoyl)benzamide Formula: C20H23BrN2O2S MolecularWeight: 435.37782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC(C)C

InChI

InChI=1S/C20H23BrN2O2S/c1-13(2)10-11-25-18-9-6-15(21)12-17(18)19(24)23-20(26)22-16-7-4-14(3)5-8-16/h4-9,12-13H,10-11H2,1-3H3,(H2,22,23,24,26)