ethyl 1-[3-[(4-tert-butylphenyl)sulfonylamino]-5-chloranyl-pyridin-2-yl]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[3-[(4-tert-butylphenyl)sulfonylamino]-5-chloranyl-pyridin-2-yl]pyrazole-4-carboxylate Openeye Name: ethyl 1-[3-[(4-tert-butylphenyl)sulfonylamino]-5-chloro-2-pyridyl]pyrazole-4-carboxylate CAS Name: 1-[3-[(4-tert-butylphenyl)sulfonylamino]-5-chloro-2-pyridinyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(4-tert-butylphenyl)sulfonylamino]-5-chloropyridin-2-yl]pyrazole-4-carboxylate Traditional Name: 1-[3-[(4-tert-butylphenyl)sulfonylamino]-5-chloro-2-pyridyl]pyrazole-4-carboxylic acid ethyl ester Formula: C21H23ClN4O4S MolecularWeight: 462.94972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=C1)C2=NC=C(C=C2NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)Cl

Isomeric SMILES

CCOC(=O)C1=CN(N=C1)C2=NC=C(C=C2NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)Cl

InChI

InChI=1S/C21H23ClN4O4S/c1-5-30-20(27)14-11-24-26(13-14)19-18(10-16(22)12-23-19)25-31(28,29)17-8-6-15(7-9-17)21(2,3)4/h6-13,25H,5H2,1-4H3