N-tert-butyl-4-(4,5-dimethylpyrimidin-2-yl)-2-sulfanyl-benzamide

Systemtic Name: N-tert-butyl-4-(4,5-dimethylpyrimidin-2-yl)-2-sulfanyl-benzamide Openeye Name: N-tert-butyl-4-(4,5-dimethylpyrimidin-2-yl)-2-sulfanyl-benzamide CAS Name: N-tert-butyl-4-(4,5-dimethyl-2-pyrimidinyl)-2-mercaptobenzamide IUPAC Name: N-tert-butyl-4-(4,5-dimethylpyrimidin-2-yl)-2-sulfanylbenzamide Traditional Name: N-tert-butyl-4-(4,5-dimethylpyrimidin-2-yl)-2-mercapto-benzamide Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C)C2=CC(=C(C=C2)C(=O)NC(C)(C)C)S

Isomeric SMILES

CC1=CN=C(N=C1C)C2=CC(=C(C=C2)C(=O)NC(C)(C)C)S

InChI

InChI=1S/C17H21N3OS/c1-10-9-18-15(19-11(10)2)12-6-7-13(14(22)8-12)16(21)20-17(3,4)5/h6-9,22H,1-5H3,(H,20,21)