4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(2-morpholin-4-ylethyl)benzamide

Systemtic Name: 4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: 4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(2-morpholinoethyl)benzamide CAS Name: 4-[[[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]methyl]-N-[2-(4-morpholinyl)ethyl]benzamide IUPAC Name: 4-[(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)sulfanylmethyl]-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 4-[[(4-methyl-6-pyrrolidino-pyrimidin-2-yl)thio]methyl]-N-(2-morpholinoethyl)benzamide Formula: C23H31N5O2S MolecularWeight: 441.58954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCCN3CCOCC3)N4CCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCCN3CCOCC3)N4CCCC4

InChI

InChI=1S/C23H31N5O2S/c1-18-16-21(28-9-2-3-10-28)26-23(25-18)31-17-19-4-6-20(7-5-19)22(29)24-8-11-27-12-14-30-15-13-27/h4-7,16H,2-3,8-15,17H2,1H3,(H,24,29)