2-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)pyrazol-1-yl]acetic acid CAS Name: 2-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)pyrazol-1-yl]acetic acid Traditional Name: 2-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)pyrazol-1-yl]acetic acid Formula: C12H13N3O4S2 MolecularWeight: 327.37932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1SC=C2)S(=O)(=O)C3=CN(N=C3)CC(=O)O

Isomeric SMILES

C1CN(CC2=C1SC=C2)S(=O)(=O)C3=CN(N=C3)CC(=O)O

InChI

InChI=1S/C12H13N3O4S2/c16-12(17)8-14-7-10(5-13-14)21(18,19)15-3-1-11-9(6-15)2-4-20-11/h2,4-5,7H,1,3,6,8H2,(H,16,17)