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

Systemtic Name: 4-[(4-morpholin-4-yl-6-propan-2-yl-pyrimidin-2-yl)sulfanylmethyl]-N-propan-2-yl-benzamide Openeye Name: N-isopropyl-4-[(4-isopropyl-6-morpholino-pyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: 4-[[[4-(4-morpholinyl)-6-propan-2-yl-2-pyrimidinyl]thio]methyl]-N-propan-2-ylbenzamide IUPAC Name: 4-[(4-morpholin-4-yl-6-propan-2-ylpyrimidin-2-yl)sulfanylmethyl]-N-propan-2-ylbenzamide Traditional Name: N-isopropyl-4-[[(4-isopropyl-6-morpholino-pyrimidin-2-yl)thio]methyl]benzamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NC(C)C)N3CCOCC3

Isomeric SMILES

CC(C)C1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NC(C)C)N3CCOCC3

InChI

InChI=1S/C22H30N4O2S/c1-15(2)19-13-20(26-9-11-28-12-10-26)25-22(24-19)29-14-17-5-7-18(8-6-17)21(27)23-16(3)4/h5-8,13,15-16H,9-12,14H2,1-4H3,(H,23,27)