methyl 3-[[(2S)-2-(6-methylpyrimidin-4-yl)sulfanylpropanoyl]amino]benzoate

Systemtic Name: methyl 3-[[(2S)-2-(6-methylpyrimidin-4-yl)sulfanylpropanoyl]amino]benzoate Openeye Name: methyl 3-[[(2S)-2-(6-methylpyrimidin-4-yl)sulfanylpropanoyl]amino]benzoate CAS Name: 3-[[(2S)-2-[(6-methyl-4-pyrimidinyl)thio]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[(2S)-2-(6-methylpyrimidin-4-yl)sulfanylpropanoyl]amino]benzoate Traditional Name: 3-[[(2S)-2-[(6-methylpyrimidin-4-yl)thio]propanoyl]amino]benzoic acid methyl ester Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)SC(C)C(=O)NC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=NC=N1)S[C@@H](C)C(=O)NC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C16H17N3O3S/c1-10-7-14(18-9-17-10)23-11(2)15(20)19-13-6-4-5-12(8-13)16(21)22-3/h4-9,11H,1-3H3,(H,19,20)/t11-/m0/s1