N-[(5-bromanyl-6-methyl-pyridin-2-yl)carbamothioyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(5-bromanyl-6-methyl-pyridin-2-yl)carbamothioyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[(5-bromo-6-methyl-2-pyridyl)carbamothioyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[[(5-bromo-6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(5-bromo-6-methylpyridin-2-yl)carbamothioyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[(5-bromo-6-methyl-2-pyridyl)thiocarbamoyl]-3-chloro-benzothiophene-2-carboxamide Formula: C16H11BrClN3OS2 MolecularWeight: 440.76504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)Br

Isomeric SMILES

CC1=C(C=CC(=N1)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)Br

InChI

InChI=1S/C16H11BrClN3OS2/c1-8-10(17)6-7-12(19-8)20-16(23)21-15(22)14-13(18)9-4-2-3-5-11(9)24-14/h2-7H,1H3,(H2,19,20,21,22,23)