ethyl 2-[[1-[(4-chloranyl-3-methyl-phenoxy)methyl]pyrazol-3-yl]carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[1-[(4-chloranyl-3-methyl-phenoxy)methyl]pyrazol-3-yl]carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[[1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazole-3-carbonyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[[1-[(4-chloro-3-methylphenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[[1-[(4-chloro-3-methylphenoxy)methyl]pyrazole-3-carbonyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazole-3-carbonyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H22ClN3O5S MolecularWeight: 475.94518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=NN(C=C2)COC3=CC(=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=NN(C=C2)COC3=CC(=C(C=C3)Cl)C

InChI

InChI=1S/C22H22ClN3O5S/c1-5-30-22(29)18-13(3)19(14(4)27)32-21(18)24-20(28)17-8-9-26(25-17)11-31-15-6-7-16(23)12(2)10-15/h6-10H,5,11H2,1-4H3,(H,24,28)