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

Systemtic Name: ethyl 5-azanyl-3-[(4-bromophenyl)sulfonylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-3-[(4-bromophenyl)sulfonylamino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-amino-3-[(4-bromophenyl)sulfonylamino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[(4-bromophenyl)sulfonylamino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-amino-3-(brosylamino)-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C18H17BrN4O4S MolecularWeight: 465.32098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrN4O4S/c1-2-27-18(24)15-16(20)23(13-6-4-3-5-7-13)21-17(15)22-28(25,26)14-10-8-12(19)9-11-14/h3-11H,2,20H2,1H3,(H,21,22)