3-bromanyl-N-(butylcarbamothioyl)-4-(3-methylbutoxy)benzamide

Systemtic Name: 3-bromanyl-N-(butylcarbamothioyl)-4-(3-methylbutoxy)benzamide Openeye Name: 3-bromo-N-(butylcarbamothioyl)-4-isopentyloxy-benzamide CAS Name: 3-bromo-N-[butylamino(sulfanylidene)methyl]-4-(3-methylbutoxy)benzamide IUPAC Name: 3-bromo-N-(butylcarbamothioyl)-4-(3-methylbutoxy)benzamide Traditional Name: 3-bromo-N-(butylthiocarbamoyl)-4-isoamoxy-benzamide Formula: C17H25BrN2O2S MolecularWeight: 401.3616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC(=O)C1=CC(=C(C=C1)OCCC(C)C)Br

Isomeric SMILES

CCCCNC(=S)NC(=O)C1=CC(=C(C=C1)OCCC(C)C)Br

InChI

InChI=1S/C17H25BrN2O2S/c1-4-5-9-19-17(23)20-16(21)13-6-7-15(14(18)11-13)22-10-8-12(2)3/h6-7,11-12H,4-5,8-10H2,1-3H3,(H2,19,20,21,23)