3-bromanyl-N-(2-diethylaminoethylcarbamothioyl)-4-(2-methylpropoxy)benzamide

Systemtic Name: 3-bromanyl-N-(2-diethylaminoethylcarbamothioyl)-4-(2-methylpropoxy)benzamide Openeye Name: 3-bromo-N-(2-diethylaminoethylcarbamothioyl)-4-isobutoxy-benzamide CAS Name: 3-bromo-N-[(2-diethylaminoethylamino)-sulfanylidenemethyl]-4-(2-methylpropoxy)benzamide IUPAC Name: 3-bromo-N-(2-diethylaminoethylcarbamothioyl)-4-(2-methylpropoxy)benzamide Traditional Name: 3-bromo-N-(2-diethylaminoethylthiocarbamoyl)-4-isobutoxy-benzamide Formula: C18H28BrN3O2S MolecularWeight: 430.40282

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=S)NC(=O)C1=CC(=C(C=C1)OCC(C)C)Br

Isomeric SMILES

CCN(CC)CCNC(=S)NC(=O)C1=CC(=C(C=C1)OCC(C)C)Br

InChI

InChI=1S/C18H28BrN3O2S/c1-5-22(6-2)10-9-20-18(25)21-17(23)14-7-8-16(15(19)11-14)24-12-13(3)4/h7-8,11,13H,5-6,9-10,12H2,1-4H3,(H2,20,21,23,25)