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

Systemtic Name: N-(6-azanyl-2-ethylsulfanyl-pyrimidin-4-yl)-4-tert-butyl-benzamide Openeye Name: N-(6-amino-2-ethylsulfanyl-pyrimidin-4-yl)-4-tert-butyl-benzamide CAS Name: N-[6-amino-2-(ethylthio)-4-pyrimidinyl]-4-tert-butylbenzamide IUPAC Name: N-(6-amino-2-ethylsulfanylpyrimidin-4-yl)-4-tert-butylbenzamide Traditional Name: N-[6-amino-2-(ethylthio)pyrimidin-4-yl]-4-tert-butyl-benzamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=CC(=N1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)N

Isomeric SMILES

CCSC1=NC(=CC(=N1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)N

InChI

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