2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl-(phenylmethyl)amino]-N-(4-methoxyphenyl)-3-methyl-butanamide

Systemtic Name: 2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl-(phenylmethyl)amino]-N-(4-methoxyphenyl)-3-methyl-butanamide Openeye Name: 2-[benzyl-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-N-(4-methoxyphenyl)-3-methyl-butanamide CAS Name: 2-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]-(phenylmethyl)amino]-N-(4-methoxyphenyl)-3-methylbutanamide IUPAC Name: 2-[benzyl-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-N-(4-methoxyphenyl)-3-methylbutanamide Traditional Name: 2-[benzyl-[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]amino]-N-(4-methoxyphenyl)-3-methyl-butyramide Formula: C27H32N4O3S MolecularWeight: 492.63298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N(CC2=CC=CC=C2)C(C(C)C)C(=O)NC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N(CC2=CC=CC=C2)C(C(C)C)C(=O)NC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C27H32N4O3S/c1-18(2)25(26(33)30-22-11-13-23(34-5)14-12-22)31(16-21-9-7-6-8-10-21)24(32)17-35-27-28-19(3)15-20(4)29-27/h6-15,18,25H,16-17H2,1-5H3,(H,30,33)