ethyl 2-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]benzoate

Systemtic Name: ethyl 2-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]benzoate Openeye Name: ethyl 2-[[5-(methylsulfanylmethyl)-2-furyl]methylamino]benzoate CAS Name: 2-[[5-[(methylthio)methyl]-2-furanyl]methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]benzoate Traditional Name: 2-[[5-[(methylthio)methyl]-2-furyl]methylamino]benzoic acid ethyl ester Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NCC2=CC=C(O2)CSC

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NCC2=CC=C(O2)CSC

InChI

InChI=1S/C16H19NO3S/c1-3-19-16(18)14-6-4-5-7-15(14)17-10-12-8-9-13(20-12)11-21-2/h4-9,17H,3,10-11H2,1-2H3