methyl 4-[[2-[2-(furan-2-ylcarbonylamino)-1,3-thiazol-4-yl]ethanoyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[2-(furan-2-ylcarbonylamino)-1,3-thiazol-4-yl]ethanoyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[2-[2-(furan-2-carbonylamino)thiazol-4-yl]acetyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[2-[2-[[2-furanyl(oxo)methyl]amino]-4-thiazolyl]-1-oxoethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[2-(furan-2-carbonylamino)-1,3-thiazol-4-yl]acetyl]-methylamino]methyl]benzoate Traditional Name: 4-[[[2-[2-(2-furoylamino)thiazol-4-yl]acetyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)CC2=CSC(=N2)NC(=O)C3=CC=CO3

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)CC2=CSC(=N2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C20H19N3O5S/c1-23(11-13-5-7-14(8-6-13)19(26)27-2)17(24)10-15-12-29-20(21-15)22-18(25)16-4-3-9-28-16/h3-9,12H,10-11H2,1-2H3,(H,21,22,25)