3-bromanyl-4-butoxy-N-(propan-2-ylcarbamothioyl)benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-(propan-2-ylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-butoxy-N-(isopropylcarbamothioyl)benzamide CAS Name: 3-bromo-4-butoxy-N-[(propan-2-ylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-(propan-2-ylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-butoxy-N-(isopropylthiocarbamoyl)benzamide Formula: C15H21BrN2O2S MolecularWeight: 373.30844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC(C)C)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC(C)C)Br

InChI

InChI=1S/C15H21BrN2O2S/c1-4-5-8-20-13-7-6-11(9-12(13)16)14(19)18-15(21)17-10(2)3/h6-7,9-10H,4-5,8H2,1-3H3,(H2,17,18,19,21)