N-(furan-2-ylmethyl)-3-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(furan-2-ylmethyl)-3-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-(2-furylmethyl)-3-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-(2-furanylmethyl)-3-[[[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-(furan-2-ylmethyl)-3-[(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(2-furfuryl)-3-[[(4-methyl-6-pyrrolidino-pyrimidin-2-yl)thio]methyl]benzamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC(=C2)C(=O)NCC3=CC=CO3)N4CCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC(=C2)C(=O)NCC3=CC=CO3)N4CCCC4

InChI

InChI=1S/C22H24N4O2S/c1-16-12-20(26-9-2-3-10-26)25-22(24-16)29-15-17-6-4-7-18(13-17)21(27)23-14-19-8-5-11-28-19/h4-8,11-13H,2-3,9-10,14-15H2,1H3,(H,23,27)