5-bromanyl-N-[[4-(diethylamino)-2-methyl-phenyl]carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[4-(diethylamino)-2-methyl-phenyl]carbamothioyl]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[[4-(diethylamino)-2-methyl-phenyl]carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[[4-(diethylamino)-2-methylanilino]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[[4-(diethylamino)-2-methylphenyl]carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[[4-(diethylamino)-2-methyl-phenyl]thiocarbamoyl]-2-methoxy-benzamide 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)C2=C(C=CC(=C2)Br)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C20H24BrN3O2S/c1-5-24(6-2)15-8-9-17(13(3)11-15)22-20(27)23-19(25)16-12-14(21)7-10-18(16)26-4/h7-12H,5-6H2,1-4H3,(H2,22,23,25,27)