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

Systemtic Name: 4-[(4-ethyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(furan-2-ylmethyl)benzamide Openeye Name: 4-[(4-ethyl-6-morpholino-pyrimidin-2-yl)sulfanylmethyl]-N-(2-furylmethyl)benzamide CAS Name: 4-[[[4-ethyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]methyl]-N-(2-furanylmethyl)benzamide IUPAC Name: 4-[(4-ethyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanylmethyl]-N-(furan-2-ylmethyl)benzamide Traditional Name: 4-[[(4-ethyl-6-morpholino-pyrimidin-2-yl)thio]methyl]-N-(2-furfuryl)benzamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC3=CC=CO3)N4CCOCC4

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC3=CC=CO3)N4CCOCC4

InChI

InChI=1S/C23H26N4O3S/c1-2-19-14-21(27-9-12-29-13-10-27)26-23(25-19)31-16-17-5-7-18(8-6-17)22(28)24-15-20-4-3-11-30-20/h3-8,11,14H,2,9-10,12-13,15-16H2,1H3,(H,24,28)