2-[2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanylethanoyl-methyl-amino]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanylethanoyl-methyl-amino]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[[2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanylacetyl]-methyl-amino]-N-(p-tolyl)acetamide CAS Name: 2-[[2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-1-oxoethyl]-methylamino]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[[2-(4-amino-6-methylpyrimidin-2-yl)sulfanylacetyl]-methylamino]-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]acetyl]-methyl-amino]-N-(p-tolyl)acetamide Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)CSC2=NC(=CC(=N2)N)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)CSC2=NC(=CC(=N2)N)C

InChI

InChI=1S/C17H21N5O2S/c1-11-4-6-13(7-5-11)20-15(23)9-22(3)16(24)10-25-17-19-12(2)8-14(18)21-17/h4-8H,9-10H2,1-3H3,(H,20,23)(H2,18,19,21)