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

Systemtic Name: 5-bromanyl-N-[(butanoylamino)carbamothioyl]-2-(3-methylbutoxy)benzamide Openeye Name: 5-bromo-N-[(butanoylamino)carbamothioyl]-2-isopentyloxy-benzamide CAS Name: 5-bromo-2-(3-methylbutoxy)-N-[(1-oxobutylhydrazo)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-N-[(butanoylamino)carbamothioyl]-2-(3-methylbutoxy)benzamide Traditional Name: 5-bromo-N-(butyramidothiocarbamoyl)-2-isoamoxy-benzamide Formula: C17H24BrN3O3S MolecularWeight: 430.35976

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NNC(=S)NC(=O)C1=C(C=CC(=C1)Br)OCCC(C)C

Isomeric SMILES

CCCC(=O)NNC(=S)NC(=O)C1=C(C=CC(=C1)Br)OCCC(C)C

InChI

InChI=1S/C17H24BrN3O3S/c1-4-5-15(22)20-21-17(25)19-16(23)13-10-12(18)6-7-14(13)24-9-8-11(2)3/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,20,22)(H2,19,21,23,25)