3-azanyl-N-tert-butyl-4-(4,6-dimethylpyrimidin-2-yl)-2-sulfanyl-benzamide

Systemtic Name: 3-azanyl-N-tert-butyl-4-(4,6-dimethylpyrimidin-2-yl)-2-sulfanyl-benzamide Openeye Name: 3-amino-N-tert-butyl-4-(4,6-dimethylpyrimidin-2-yl)-2-sulfanyl-benzamide CAS Name: 3-amino-N-tert-butyl-4-(4,6-dimethyl-2-pyrimidinyl)-2-mercaptobenzamide IUPAC Name: 3-amino-N-tert-butyl-4-(4,6-dimethylpyrimidin-2-yl)-2-sulfanylbenzamide Traditional Name: 3-amino-N-tert-butyl-4-(4,6-dimethylpyrimidin-2-yl)-2-mercapto-benzamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4OS/c1-9-8-10(2)20-15(19-9)11-6-7-12(14(23)13(11)18)16(22)21-17(3,4)5/h6-8,23H,18H2,1-5H3,(H,21,22)