N-[[3,5-bis(bromanyl)-6-methyl-pyridin-2-yl]carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[[3,5-bis(bromanyl)-6-methyl-pyridin-2-yl]carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: N-[(3,5-dibromo-6-methyl-2-pyridyl)carbamothioyl]-4-isopropyl-benzamide CAS Name: N-[[(3,5-dibromo-6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[(3,5-dibromo-6-methylpyridin-2-yl)carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[(3,5-dibromo-6-methyl-2-pyridyl)thiocarbamoyl]-4-isopropyl-benzamide Formula: C17H17Br2N3OS MolecularWeight: 471.20938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1Br)Br)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=NC(=C(C=C1Br)Br)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C17H17Br2N3OS/c1-9(2)11-4-6-12(7-5-11)16(23)22-17(24)21-15-14(19)8-13(18)10(3)20-15/h4-9H,1-3H3,(H2,20,21,22,23,24)