2-(4-bromanyl-3-methyl-phenoxy)-N-[[4-(diethylamino)phenyl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-3-methyl-phenoxy)-N-[[4-(diethylamino)phenyl]carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-3-methyl-phenoxy)-N-[[4-(diethylamino)phenyl]carbamothioyl]acetamide CAS Name: 2-(4-bromo-3-methylphenoxy)-N-[[4-(diethylamino)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-3-methylphenoxy)-N-[[4-(diethylamino)phenyl]carbamothioyl]acetamide Traditional Name: 2-(4-bromo-3-methyl-phenoxy)-N-[[4-(diethylamino)phenyl]thiocarbamoyl]acetamide Formula: C20H24BrN3O2S MolecularWeight: 450.39246

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC(=C(C=C2)Br)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC(=C(C=C2)Br)C

InChI

InChI=1S/C20H24BrN3O2S/c1-4-24(5-2)16-8-6-15(7-9-16)22-20(27)23-19(25)13-26-17-10-11-18(21)14(3)12-17/h6-12H,4-5,13H2,1-3H3,(H2,22,23,25,27)