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

Systemtic Name: 3-bromanyl-4-(3-methylbutoxy)-N-[(4-methylphenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-isopentyloxy-N-(p-tolylcarbamothioyl)benzamide CAS Name: 3-bromo-N-[(4-methylanilino)-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: 3-bromo-4-(3-methylbutoxy)-N-[(4-methylphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-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=CC(=C(C=C2)OCCC(C)C)Br

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN2O2S/c1-13(2)10-11-25-18-9-6-15(12-17(18)21)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)