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

Systemtic Name: 3-[[4,5-dimethyl-6-[methyl-(phenylmethyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-benzamide Openeye Name: 3-[[4-[benzyl(methyl)amino]-5,6-dimethyl-pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-benzamide CAS Name: 3-[[[4,5-dimethyl-6-[methyl-(phenylmethyl)amino]-2-pyrimidinyl]thio]methyl]-N-ethylbenzamide IUPAC Name: 3-[[4-[benzyl(methyl)amino]-5,6-dimethylpyrimidin-2-yl]sulfanylmethyl]-N-ethylbenzamide Traditional Name: 3-[[[4-[benzyl(methyl)amino]-5,6-dimethyl-pyrimidin-2-yl]thio]methyl]-N-ethyl-benzamide Formula: C24H28N4OS MolecularWeight: 420.57032

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)CSC2=NC(=C(C(=N2)N(C)CC3=CC=CC=C3)C)C

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)CSC2=NC(=C(C(=N2)N(C)CC3=CC=CC=C3)C)C

InChI

InChI=1S/C24H28N4OS/c1-5-25-23(29)21-13-9-12-20(14-21)16-30-24-26-18(3)17(2)22(27-24)28(4)15-19-10-7-6-8-11-19/h6-14H,5,15-16H2,1-4H3,(H,25,29)