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

Systemtic Name: 3-[(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]-N-propan-2-yl-benzamide Openeye Name: N-isopropyl-3-[(4-methyl-6-morpholino-pyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: 3-[[[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]methyl]-N-propan-2-ylbenzamide IUPAC Name: 3-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanylmethyl]-N-propan-2-ylbenzamide Traditional Name: N-isopropyl-3-[[(4-methyl-6-morpholino-pyrimidin-2-yl)thio]methyl]benzamide Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC(=C2)C(=O)NC(C)C)N3CCOCC3

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC(=C2)C(=O)NC(C)C)N3CCOCC3

InChI

InChI=1S/C20H26N4O2S/c1-14(2)21-19(25)17-6-4-5-16(12-17)13-27-20-22-15(3)11-18(23-20)24-7-9-26-10-8-24/h4-6,11-12,14H,7-10,13H2,1-3H3,(H,21,25)