5-bromanyl-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[[(4,6-dimethyl-2-pyrimidinyl)amino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[(4,6-dimethylpyrimidin-2-yl)thiocarbamoyl]-1-naphthamide Formula: C18H15BrN4OS MolecularWeight: 415.3069

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Br)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Br)C

InChI

InChI=1S/C18H15BrN4OS/c1-10-9-11(2)21-17(20-10)23-18(25)22-16(24)14-7-3-6-13-12(14)5-4-8-15(13)19/h3-9H,1-2H3,(H2,20,21,22,23,24,25)