N-ethyl-4-[[4-(methoxymethyl)-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-ethyl-4-[[4-(methoxymethyl)-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: N-ethyl-4-[[4-(methoxymethyl)-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: N-ethyl-4-[[[4-(methoxymethyl)-6-[methyl(propyl)amino]-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-ethyl-4-[[4-(methoxymethyl)-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-ethyl-4-[[[4-(methoxymethyl)-6-[methyl(propyl)amino]pyrimidin-2-yl]thio]methyl]benzamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C1=NC(=NC(=C1)COC)SCC2=CC=C(C=C2)C(=O)NCC

Isomeric SMILES

CCCN(C)C1=NC(=NC(=C1)COC)SCC2=CC=C(C=C2)C(=O)NCC

InChI

InChI=1S/C20H28N4O2S/c1-5-11-24(3)18-12-17(13-26-4)22-20(23-18)27-14-15-7-9-16(10-8-15)19(25)21-6-2/h7-10,12H,5-6,11,13-14H2,1-4H3,(H,21,25)