methyl 3-[(5-azanyl-2-oxidanylidene-1,3-dihydroindol-6-yl)sulfanyl]propanoate

Systemtic Name: methyl 3-[(5-azanyl-2-oxidanylidene-1,3-dihydroindol-6-yl)sulfanyl]propanoate Openeye Name: methyl 3-(5-amino-2-oxo-indolin-6-yl)sulfanylpropanoate CAS Name: 3-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)sulfanyl]propanoate Traditional Name: 3-[(5-amino-2-keto-indolin-6-yl)thio]propionic acid methyl ester Formula: C12H14N2O3S MolecularWeight: 266.31616

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=C(C=C2CC(=O)NC2=C1)N

Isomeric SMILES

COC(=O)CCSC1=C(C=C2CC(=O)NC2=C1)N

InChI

InChI=1S/C12H14N2O3S/c1-17-12(16)2-3-18-10-6-9-7(4-8(10)13)5-11(15)14-9/h4,6H,2-3,5,13H2,1H3,(H,14,15)