methyl 2-[2-[2-(pyrazin-2-ylcarbonylamino)-1,3-thiazol-4-yl]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[2-(pyrazin-2-ylcarbonylamino)-1,3-thiazol-4-yl]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[2-(pyrazine-2-carbonylamino)thiazol-4-yl]acetyl]amino]benzoate CAS Name: 2-[[1-oxo-2-[2-[[oxo(2-pyrazinyl)methyl]amino]-4-thiazolyl]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[2-(pyrazine-2-carbonylamino)-1,3-thiazol-4-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[2-(pyrazinoylamino)thiazol-4-yl]acetyl]amino]benzoic acid methyl ester Formula: C18H15N5O4S MolecularWeight: 397.4078

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CC2=CSC(=N2)NC(=O)C3=NC=CN=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CC2=CSC(=N2)NC(=O)C3=NC=CN=C3

InChI

InChI=1S/C18H15N5O4S/c1-27-17(26)12-4-2-3-5-13(12)22-15(24)8-11-10-28-18(21-11)23-16(25)14-9-19-6-7-20-14/h2-7,9-10H,8H2,1H3,(H,22,24)(H,21,23,25)