3-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide

Systemtic Name: 3-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide Openeye Name: 3-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide CAS Name: 3-[[[4-tert-butyl-6-(diethylamino)-2-pyrimidinyl]thio]methyl]-N-(2-methoxyethyl)benzamide IUPAC Name: 3-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide Traditional Name: 3-[[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]thio]methyl]-N-(2-methoxyethyl)benzamide Formula: C23H34N4O2S MolecularWeight: 430.60666

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1)C(C)(C)C)SCC2=CC=CC(=C2)C(=O)NCCOC

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1)C(C)(C)C)SCC2=CC=CC(=C2)C(=O)NCCOC

InChI

InChI=1S/C23H34N4O2S/c1-7-27(8-2)20-15-19(23(3,4)5)25-22(26-20)30-16-17-10-9-11-18(14-17)21(28)24-12-13-29-6/h9-11,14-15H,7-8,12-13,16H2,1-6H3,(H,24,28)