3-[[4,5-dimethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-benzamide

Systemtic Name: 3-[[4,5-dimethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-benzamide Openeye Name: 3-[[4,5-dimethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-benzamide CAS Name: 3-[[[4,5-dimethyl-6-[methyl(propyl)amino]-2-pyrimidinyl]thio]methyl]-N-ethylbenzamide IUPAC Name: 3-[[4,5-dimethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-ethylbenzamide Traditional Name: 3-[[[4,5-dimethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]thio]methyl]-N-ethyl-benzamide Formula: C20H28N4OS MolecularWeight: 372.52752

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C1=NC(=NC(=C1C)C)SCC2=CC=CC(=C2)C(=O)NCC

Isomeric SMILES

CCCN(C)C1=NC(=NC(=C1C)C)SCC2=CC=CC(=C2)C(=O)NCC

InChI

InChI=1S/C20H28N4OS/c1-6-11-24(5)18-14(3)15(4)22-20(23-18)26-13-16-9-8-10-17(12-16)19(25)21-7-2/h8-10,12H,6-7,11,13H2,1-5H3,(H,21,25)