2-azanyl-3-[2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-[methyl-[(5-methyl-2-furyl)methyl]amino]-2-oxo-ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-[methyl-[(5-methyl-2-furanyl)methyl]amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-keto-2-[methyl-[(5-methyl-2-furyl)methyl]amino]ethyl]thio]propionic acid Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)C(=O)CSCC(C(=O)O)N

Isomeric SMILES

CC1=CC=C(O1)CN(C)C(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C12H18N2O4S/c1-8-3-4-9(18-8)5-14(2)11(15)7-19-6-10(13)12(16)17/h3-4,10H,5-7,13H2,1-2H3,(H,16,17)