methyl (2R)-2-[[4-(5-methylpyrazol-1-yl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[[4-(5-methylpyrazol-1-yl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[4-(5-methylpyrazol-1-yl)benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[[4-(5-methyl-1-pyrazolyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[4-(5-methylpyrazol-1-yl)benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[4-(5-methylpyrazol-1-yl)benzoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1C2=CC=C(C=C2)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=CC=NN1C2=CC=C(C=C2)C(=O)N[C@H](CCSC)C(=O)OC

InChI

InChI=1S/C17H21N3O3S/c1-12-8-10-18-20(12)14-6-4-13(5-7-14)16(21)19-15(9-11-24-3)17(22)23-2/h4-8,10,15H,9,11H2,1-3H3,(H,19,21)/t15-/m1/s1