N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-3,5-diethoxy-benzamide

Systemtic Name: N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-3,5-diethoxy-benzamide Openeye Name: N-[(4-bromo-2,6-dimethyl-phenyl)carbamothioyl]-3,5-diethoxy-benzamide CAS Name: N-[(4-bromo-2,6-dimethylanilino)-sulfanylidenemethyl]-3,5-diethoxybenzamide IUPAC Name: N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]-3,5-diethoxybenzamide Traditional Name: N-[(4-bromo-2,6-dimethyl-phenyl)thiocarbamoyl]-3,5-diethoxy-benzamide Formula: C20H23BrN2O3S MolecularWeight: 451.37722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2C)Br)C)OCC

Isomeric SMILES

CCOC1=CC(=CC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2C)Br)C)OCC

InChI

InChI=1S/C20H23BrN2O3S/c1-5-25-16-9-14(10-17(11-16)26-6-2)19(24)23-20(27)22-18-12(3)7-15(21)8-13(18)4/h7-11H,5-6H2,1-4H3,(H2,22,23,24,27)