5-bromanyl-2-methoxy-N-[(5-methoxy-2-oxidanyl-phenyl)carbamothioyl]-3-methyl-benzamide

Systemtic Name: 5-bromanyl-2-methoxy-N-[(5-methoxy-2-oxidanyl-phenyl)carbamothioyl]-3-methyl-benzamide Openeye Name: 5-bromo-N-[(2-hydroxy-5-methoxy-phenyl)carbamothioyl]-2-methoxy-3-methyl-benzamide CAS Name: 5-bromo-N-[(2-hydroxy-5-methoxyanilino)-sulfanylidenemethyl]-2-methoxy-3-methylbenzamide IUPAC Name: 5-bromo-N-[(2-hydroxy-5-methoxyphenyl)carbamothioyl]-2-methoxy-3-methylbenzamide Traditional Name: 5-bromo-N-[(2-hydroxy-5-methoxy-phenyl)thiocarbamoyl]-2-methoxy-3-methyl-benzamide Formula: C17H17BrN2O4S MolecularWeight: 425.29688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=C(C=CC(=C2)OC)O)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=C(C=CC(=C2)OC)O)OC

InChI

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