(2S)-2-[[1-(2-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[[1-(2-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[1-(2-methoxyphenyl)-2,5-dimethyl-pyrrole-3-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[[1-(2-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[1-(2-methoxyphenyl)-2,5-dimethylpyrrole-3-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[1-(2-methoxyphenyl)-2,5-dimethyl-pyrrole-3-carbonyl]amino]-4-(methylthio)butyrate Formula: C19H23N2O4S- MolecularWeight: 375.46192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2OC)C)C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2OC)C)C(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C19H24N2O4S/c1-12-11-14(18(22)20-15(19(23)24)9-10-26-4)13(2)21(12)16-7-5-6-8-17(16)25-3/h5-8,11,15H,9-10H2,1-4H3,(H,20,22)(H,23,24)/p-1/t15-/m0/s1