N-(4-dimethylaminophenyl)-2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl-(phenylmethyl)amino]-2-methyl-propanamide

Systemtic Name: N-(4-dimethylaminophenyl)-2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl-(phenylmethyl)amino]-2-methyl-propanamide Openeye Name: 2-[benzyl-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-N-(4-dimethylaminophenyl)-2-methyl-propanamide CAS Name: N-(4-dimethylaminophenyl)-2-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]-(phenylmethyl)amino]-2-methylpropanamide IUPAC Name: 2-[benzyl-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-N-(4-dimethylaminophenyl)-2-methylpropanamide Traditional Name: 2-[benzyl-[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]amino]-N-(4-dimethylaminophenyl)-2-methyl-propionamide Formula: C27H33N5O2S MolecularWeight: 491.64822

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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(=O)NC3=CC=C(C=C3)N(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C27H33N5O2S/c1-19-16-20(2)29-26(28-19)35-18-24(33)32(17-21-10-8-7-9-11-21)27(3,4)25(34)30-22-12-14-23(15-13-22)31(5)6/h7-16H,17-18H2,1-6H3,(H,30,34)