methyl 4-[[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylcarbamoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylcarbamoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(2-thienyl)oxazol-4-yl]methylcarbamoylamino]methyl]benzoate CAS Name: 4-[[[oxo-[(2-thiophen-2-yl-4-oxazolyl)methylamino]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylcarbamoylamino]methyl]benzoate Traditional Name: 4-[[[2-(2-thienyl)oxazol-4-yl]methylcarbamoylamino]methyl]benzoic acid methyl ester Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)NCC2=COC(=N2)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)NCC2=COC(=N2)C3=CC=CS3

InChI

InChI=1S/C18H17N3O4S/c1-24-17(22)13-6-4-12(5-7-13)9-19-18(23)20-10-14-11-25-16(21-14)15-3-2-8-26-15/h2-8,11H,9-10H2,1H3,(H2,19,20,23)