ethyl 5-azanyl-3-[(4-bromophenyl)sulfonylamino]-1-(4-chlorophenyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-3-[(4-bromophenyl)sulfonylamino]-1-(4-chlorophenyl)pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-3-[(4-bromophenyl)sulfonylamino]-1-(4-chlorophenyl)pyrazole-4-carboxylate CAS Name: 5-amino-3-[(4-bromophenyl)sulfonylamino]-1-(4-chlorophenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[(4-bromophenyl)sulfonylamino]-1-(4-chlorophenyl)pyrazole-4-carboxylate Traditional Name: 5-amino-3-(brosylamino)-1-(4-chlorophenyl)pyrazole-4-carboxylic acid ethyl ester Formula: C18H16BrClN4O4S MolecularWeight: 499.76604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1NS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Cl)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1NS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C18H16BrClN4O4S/c1-2-28-18(25)15-16(21)24(13-7-5-12(20)6-8-13)22-17(15)23-29(26,27)14-9-3-11(19)4-10-14/h3-10H,2,21H2,1H3,(H,22,23)