N-ethyl-4-[[4-(methoxymethyl)-6-pyrrolidin-1-yl-pyrimidin-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-ethyl-4-[[4-(methoxymethyl)-6-pyrrolidin-1-yl-pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: N-ethyl-4-[[4-(methoxymethyl)-6-pyrrolidin-1-yl-pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: N-ethyl-4-[[[4-(methoxymethyl)-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-ethyl-4-[[4-(methoxymethyl)-6-pyrrolidin-1-ylpyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-ethyl-4-[[[4-(methoxymethyl)-6-pyrrolidino-pyrimidin-2-yl]thio]methyl]benzamide Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N3CCCC3)COC

Isomeric SMILES

CCNC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N3CCCC3)COC

InChI

InChI=1S/C20H26N4O2S/c1-3-21-19(25)16-8-6-15(7-9-16)14-27-20-22-17(13-26-2)12-18(23-20)24-10-4-5-11-24/h6-9,12H,3-5,10-11,13-14H2,1-2H3,(H,21,25)