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

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-[[1-[(2-methylphenoxy)methyl]pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-[[1-[(2-methylphenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[[1-[(2-methylphenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-[[1-[(2-methylphenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-[[1-[(2-methylphenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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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=CC=C3C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3C

InChI

InChI=1S/C22H23N3O5S/c1-5-29-22(28)18-14(3)19(15(4)26)31-21(18)23-20(27)16-10-11-25(24-16)12-30-17-9-7-6-8-13(17)2/h6-11H,5,12H2,1-4H3,(H,23,27)