ethyl 4-methyl-2-[pentyl-[2-(1-phenylpyrazol-4-yl)ethanoyl]amino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[pentyl-[2-(1-phenylpyrazol-4-yl)ethanoyl]amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[pentyl-[2-(1-phenylpyrazol-4-yl)acetyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-(1-phenyl-4-pyrazolyl)ethyl]-pentylamino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[pentyl-[2-(1-phenylpyrazol-4-yl)acetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[amyl-[2-(1-phenylpyrazol-4-yl)acetyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H28N4O3S/c1-4-6-10-13-26(23-25-17(3)21(31-23)22(29)30-5-2)20(28)14-18-15-24-27(16-18)19-11-8-7-9-12-19/h7-9,11-12,15-16H,4-6,10,13-14H2,1-3H3