N-(6-azanyl-2-methylsulfanyl-pyrimidin-4-yl)-4-tert-butyl-benzamide

Systemtic Name: N-(6-azanyl-2-methylsulfanyl-pyrimidin-4-yl)-4-tert-butyl-benzamide Openeye Name: N-(6-amino-2-methylsulfanyl-pyrimidin-4-yl)-4-tert-butyl-benzamide CAS Name: N-[6-amino-2-(methylthio)-4-pyrimidinyl]-4-tert-butylbenzamide IUPAC Name: N-(6-amino-2-methylsulfanylpyrimidin-4-yl)-4-tert-butylbenzamide Traditional Name: N-[6-amino-2-(methylthio)pyrimidin-4-yl]-4-tert-butyl-benzamide Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NC(=NC(=C2)N)SC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NC(=NC(=C2)N)SC

InChI

InChI=1S/C16H20N4OS/c1-16(2,3)11-7-5-10(6-8-11)14(21)19-13-9-12(17)18-15(20-13)22-4/h5-9H,1-4H3,(H3,17,18,19,20,21)