ethyl 2-[2-oxidanylidene-2-[[4-(pyridin-4-ylmethyl)phenyl]amino]ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-oxidanylidene-2-[[4-(pyridin-4-ylmethyl)phenyl]amino]ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-oxo-2-[4-(4-pyridylmethyl)anilino]ethyl]sulfanylacetate CAS Name: 2-[[2-oxo-2-[4-(pyridin-4-ylmethyl)anilino]ethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-oxo-2-[4-(pyridin-4-ylmethyl)anilino]ethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-[4-(4-pyridylmethyl)anilino]ethyl]thio]acetic acid ethyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=CC=C(C=C1)CC2=CC=NC=C2

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=CC=C(C=C1)CC2=CC=NC=C2

InChI

InChI=1S/C18H20N2O3S/c1-2-23-18(22)13-24-12-17(21)20-16-5-3-14(4-6-16)11-15-7-9-19-10-8-15/h3-10H,2,11-13H2,1H3,(H,20,21)