tert-butyl 2-cyano-5-[4-(ethylsulfonylamino)phenyl]pyrrole-1-carboxylate

Systemtic Name: tert-butyl 2-cyano-5-[4-(ethylsulfonylamino)phenyl]pyrrole-1-carboxylate Openeye Name: tert-butyl 2-cyano-5-[4-(ethylsulfonylamino)phenyl]pyrrole-1-carboxylate CAS Name: 2-cyano-5-[4-(ethylsulfonylamino)phenyl]-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-cyano-5-[4-(ethylsulfonylamino)phenyl]pyrrole-1-carboxylate Traditional Name: 2-cyano-5-[4-(esylamino)phenyl]pyrrole-1-carboxylic acid tert-butyl ester Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC=C(C=C1)C2=CC=C(N2C(=O)OC(C)(C)C)C#N

Isomeric SMILES

CCS(=O)(=O)NC1=CC=C(C=C1)C2=CC=C(N2C(=O)OC(C)(C)C)C#N

InChI

InChI=1S/C18H21N3O4S/c1-5-26(23,24)20-14-8-6-13(7-9-14)16-11-10-15(12-19)21(16)17(22)25-18(2,3)4/h6-11,20H,5H2,1-4H3