3-bromanyl-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-4-methoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[[(4,6-dimethyl-2-pyrimidinyl)amino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[(4,6-dimethylpyrimidin-2-yl)thiocarbamoyl]-4-methoxy-benzamide Formula: C15H15BrN4O2S MolecularWeight: 395.2742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br)C

InChI

InChI=1S/C15H15BrN4O2S/c1-8-6-9(2)18-14(17-8)20-15(23)19-13(21)10-4-5-12(22-3)11(16)7-10/h4-7H,1-3H3,(H2,17,18,19,20,21,23)