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

Systemtic Name: 5-bromanyl-N-[(4-butoxyphenyl)carbamothioyl]-2-(3-methylbutoxy)benzamide Openeye Name: 5-bromo-N-[(4-butoxyphenyl)carbamothioyl]-2-isopentyloxy-benzamide CAS Name: 5-bromo-N-[(4-butoxyanilino)-sulfanylidenemethyl]-2-(3-methylbutoxy)benzamide IUPAC Name: 5-bromo-N-[(4-butoxyphenyl)carbamothioyl]-2-(3-methylbutoxy)benzamide Traditional Name: 5-bromo-N-[(4-butoxyphenyl)thiocarbamoyl]-2-isoamoxy-benzamide Formula: C23H29BrN2O3S MolecularWeight: 493.45696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC(C)C

InChI

InChI=1S/C23H29BrN2O3S/c1-4-5-13-28-19-9-7-18(8-10-19)25-23(30)26-22(27)20-15-17(24)6-11-21(20)29-14-12-16(2)3/h6-11,15-16H,4-5,12-14H2,1-3H3,(H2,25,26,27,30)