(2S)-N-ethyl-2-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoylamino]propanamide

Systemtic Name: (2S)-N-ethyl-2-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoylamino]propanamide Openeye Name: (2S)-N-ethyl-2-[[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]amino]propanamide CAS Name: (2S)-N-ethyl-2-[[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]propanamide IUPAC Name: (2S)-N-ethyl-2-[[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]amino]propanamide Traditional Name: (2S)-N-ethyl-2-[[2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetyl]amino]propionamide Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CSC1=NC(=CC(=N1)C)C2=CC=CC=C2

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)CSC1=NC(=CC(=N1)C)C2=CC=CC=C2

InChI

InChI=1S/C18H22N4O2S/c1-4-19-17(24)13(3)21-16(23)11-25-18-20-12(2)10-15(22-18)14-8-6-5-7-9-14/h5-10,13H,4,11H2,1-3H3,(H,19,24)(H,21,23)/t13-/m0/s1