1-[(4-bromanylpyrazol-1-yl)methyl]-N-(4-morpholin-4-ylsulfonylphenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylpyrazol-1-yl)methyl]-N-(4-morpholin-4-ylsulfonylphenyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-(4-morpholinosulfonylphenyl)pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-1-pyrazolyl)methyl]-N-[4-(4-morpholinylsulfonyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-(4-morpholin-4-ylsulfonylphenyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-(4-morpholinosulfonylphenyl)pyrazole-3-carboxamide Formula: C18H19BrN6O4S MolecularWeight: 495.35026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C=C3)CN4C=C(C=N4)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C=C3)CN4C=C(C=N4)Br

InChI

InChI=1S/C18H19BrN6O4S/c19-14-11-20-24(12-14)13-23-6-5-17(22-23)18(26)21-15-1-3-16(4-2-15)30(27,28)25-7-9-29-10-8-25/h1-6,11-12H,7-10,13H2,(H,21,26)