3-bromanyl-N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-methoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[(3,4-dimethoxyanilino)-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[(3,4-dimethoxyphenyl)thiocarbamoyl]-4-methoxy-benzamide Formula: C17H17BrN2O4S MolecularWeight: 425.29688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br)OC

InChI

InChI=1S/C17H17BrN2O4S/c1-22-13-6-4-10(8-12(13)18)16(21)20-17(25)19-11-5-7-14(23-2)15(9-11)24-3/h4-9H,1-3H3,(H2,19,20,21,25)