ethyl 2-methyl-5-[(4-morpholin-4-ylsulfonylphenyl)carbamoyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-[(4-morpholin-4-ylsulfonylphenyl)carbamoyl]pyrazole-3-carboxylate Openeye Name: ethyl 2-methyl-5-[(4-morpholinosulfonylphenyl)carbamoyl]pyrazole-3-carboxylate CAS Name: 2-methyl-5-[[4-(4-morpholinylsulfonyl)anilino]-oxomethyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-[(4-morpholin-4-ylsulfonylphenyl)carbamoyl]pyrazole-3-carboxylate Traditional Name: 2-methyl-5-[(4-morpholinosulfonylphenyl)carbamoyl]pyrazole-3-carboxylic acid ethyl ester Formula: C18H22N4O6S MolecularWeight: 422.45548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H22N4O6S/c1-3-28-18(24)16-12-15(20-21(16)2)17(23)19-13-4-6-14(7-5-13)29(25,26)22-8-10-27-11-9-22/h4-7,12H,3,8-11H2,1-2H3,(H,19,23)