ethyl 4-[2-(2-pyrrol-1-yl-1,3-thiazol-4-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(2-pyrrol-1-yl-1,3-thiazol-4-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(2-pyrrol-1-ylthiazol-4-yl)acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[2-(1-pyrrolyl)-4-thiazolyl]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(2-pyrrol-1-yl-1,3-thiazol-4-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-pyrrol-1-ylthiazol-4-yl)acetyl]amino]benzoic acid ethyl ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)N3C=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)N3C=CC=C3

InChI

InChI=1S/C18H17N3O3S/c1-2-24-17(23)13-5-7-14(8-6-13)19-16(22)11-15-12-25-18(20-15)21-9-3-4-10-21/h3-10,12H,2,11H2,1H3,(H,19,22)