(4-methylsulfanylphenyl)methyl 3-(furan-2-ylcarbonylamino)-4-methyl-benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 3-(furan-2-ylcarbonylamino)-4-methyl-benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 3-(furan-2-carbonylamino)-4-methyl-benzoate CAS Name: 3-[[2-furanyl(oxo)methyl]amino]-4-methylbenzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 3-(furan-2-carbonylamino)-4-methylbenzoate Traditional Name: 3-(2-furoylamino)-4-methyl-benzoic acid [4-(methylthio)benzyl] ester Formula: C21H19NO4S MolecularWeight: 381.44486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)SC)NC(=O)C3=CC=CO3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)SC)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H19NO4S/c1-14-5-8-16(12-18(14)22-20(23)19-4-3-11-25-19)21(24)26-13-15-6-9-17(27-2)10-7-15/h3-12H,13H2,1-2H3,(H,22,23)