methyl 4-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]benzoate

Systemtic Name: methyl 4-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]benzoate Openeye Name: methyl 4-[[5-(methylsulfanylmethyl)-2-furyl]methylamino]benzoate CAS Name: 4-[[5-[(methylthio)methyl]-2-furanyl]methylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]benzoate Traditional Name: 4-[[5-[(methylthio)methyl]-2-furyl]methylamino]benzoic acid methyl ester Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NCC2=CC=C(O2)CSC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NCC2=CC=C(O2)CSC

InChI

InChI=1S/C15H17NO3S/c1-18-15(17)11-3-5-12(6-4-11)16-9-13-7-8-14(19-13)10-20-2/h3-8,16H,9-10H2,1-2H3