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

Systemtic Name: N-(cyclopropylmethyl)-4-[(4-ethyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-(cyclopropylmethyl)-4-[(4-ethyl-6-morpholino-pyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-(cyclopropylmethyl)-4-[[[4-ethyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-(cyclopropylmethyl)-4-[(4-ethyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(cyclopropylmethyl)-4-[[(4-ethyl-6-morpholino-pyrimidin-2-yl)thio]methyl]benzamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC3CC3)N4CCOCC4

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC3CC3)N4CCOCC4

InChI

InChI=1S/C22H28N4O2S/c1-2-19-13-20(26-9-11-28-12-10-26)25-22(24-19)29-15-17-5-7-18(8-6-17)21(27)23-14-16-3-4-16/h5-8,13,16H,2-4,9-12,14-15H2,1H3,(H,23,27)