methyl 4-[3-(2-benzamido-1,3-thiazol-4-yl)propanoylamino]benzoate

Systemtic Name: methyl 4-[3-(2-benzamido-1,3-thiazol-4-yl)propanoylamino]benzoate Openeye Name: methyl 4-[3-(2-benzamidothiazol-4-yl)propanoylamino]benzoate CAS Name: 4-[[3-(2-benzamido-4-thiazolyl)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(2-benzamido-1,3-thiazol-4-yl)propanoylamino]benzoate Traditional Name: 4-[3-(2-benzamidothiazol-4-yl)propanoylamino]benzoic acid methyl ester Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CCC2=CSC(=N2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CCC2=CSC(=N2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O4S/c1-28-20(27)15-7-9-16(10-8-15)22-18(25)12-11-17-13-29-21(23-17)24-19(26)14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3,(H,22,25)(H,23,24,26)