2-[bis(2-methylpyridin-3-yl)amino]ethyl (2R)-2-azanyl-3-sulfanyl-propanoate

Systemtic Name: 2-[bis(2-methylpyridin-3-yl)amino]ethyl (2R)-2-azanyl-3-sulfanyl-propanoate Openeye Name: 2-[bis(2-methyl-3-pyridyl)amino]ethyl (2R)-2-amino-3-sulfanyl-propanoate CAS Name: (2R)-2-amino-3-mercaptopropanoic acid 2-[bis(2-methyl-3-pyridinyl)amino]ethyl ester IUPAC Name: 2-[bis(2-methylpyridin-3-yl)amino]ethyl (2R)-2-amino-3-sulfanylpropanoate Traditional Name: (2R)-2-amino-3-mercapto-propionic acid 2-[bis(2-methyl-3-pyridyl)amino]ethyl ester Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)N(CCOC(=O)C(CS)N)C2=C(N=CC=C2)C

Isomeric SMILES

CC1=C(C=CC=N1)N(CCOC(=O)[C@H](CS)N)C2=C(N=CC=C2)C

InChI

InChI=1S/C17H22N4O2S/c1-12-15(5-3-7-19-12)21(16-6-4-8-20-13(16)2)9-10-23-17(22)14(18)11-24/h3-8,14,24H,9-11,18H2,1-2H3/t14-/m0/s1