N-tert-butyl-4-(4-chloranyl-6-methyl-pyrimidin-2-yl)-2-sulfanyl-benzamide

Systemtic Name: N-tert-butyl-4-(4-chloranyl-6-methyl-pyrimidin-2-yl)-2-sulfanyl-benzamide Openeye Name: N-tert-butyl-4-(4-chloro-6-methyl-pyrimidin-2-yl)-2-sulfanyl-benzamide CAS Name: N-tert-butyl-4-(4-chloro-6-methyl-2-pyrimidinyl)-2-mercaptobenzamide IUPAC Name: N-tert-butyl-4-(4-chloro-6-methylpyrimidin-2-yl)-2-sulfanylbenzamide Traditional Name: N-tert-butyl-4-(4-chloro-6-methyl-pyrimidin-2-yl)-2-mercapto-benzamide Formula: C16H18ClN3OS MolecularWeight: 335.85162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClN3OS/c1-9-7-13(17)19-14(18-9)10-5-6-11(12(22)8-10)15(21)20-16(2,3)4/h5-8,22H,1-4H3,(H,20,21)