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

Systemtic Name: 3-[(4-tert-butyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]-N-propan-2-yl-benzamide Openeye Name: 3-[(4-tert-butyl-6-morpholino-pyrimidin-2-yl)sulfanylmethyl]-N-isopropyl-benzamide CAS Name: 3-[[[4-tert-butyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]methyl]-N-propan-2-ylbenzamide IUPAC Name: 3-[(4-tert-butyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanylmethyl]-N-propan-2-ylbenzamide Traditional Name: 3-[[(4-tert-butyl-6-morpholino-pyrimidin-2-yl)thio]methyl]-N-isopropyl-benzamide Formula: C23H32N4O2S MolecularWeight: 428.59078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC(=CC=C1)CSC2=NC(=CC(=N2)N3CCOCC3)C(C)(C)C

Isomeric SMILES

CC(C)NC(=O)C1=CC(=CC=C1)CSC2=NC(=CC(=N2)N3CCOCC3)C(C)(C)C

InChI

InChI=1S/C23H32N4O2S/c1-16(2)24-21(28)18-8-6-7-17(13-18)15-30-22-25-19(23(3,4)5)14-20(26-22)27-9-11-29-12-10-27/h6-8,13-14,16H,9-12,15H2,1-5H3,(H,24,28)