2-azanyl-6-(4-methoxyphenyl)sulfonyl-3-methyl-5-pyridin-3-yl-4-(pyridin-3-ylmethyl)benzoic acid

Systemtic Name: 2-azanyl-6-(4-methoxyphenyl)sulfonyl-3-methyl-5-pyridin-3-yl-4-(pyridin-3-ylmethyl)benzoic acid Openeye Name: 2-amino-6-(4-methoxyphenyl)sulfonyl-3-methyl-5-(3-pyridyl)-4-(3-pyridylmethyl)benzoic acid CAS Name: 2-amino-6-(4-methoxyphenyl)sulfonyl-3-methyl-5-(3-pyridinyl)-4-(3-pyridinylmethyl)benzoic acid IUPAC Name: 2-amino-6-(4-methoxyphenyl)sulfonyl-3-methyl-5-pyridin-3-yl-4-(pyridin-3-ylmethyl)benzoic acid Traditional Name: 2-amino-6-(4-methoxyphenyl)sulfonyl-3-methyl-5-(3-pyridyl)-4-(3-pyridylmethyl)benzoic acid Formula: C26H23N3O5S MolecularWeight: 489.54292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1CC2=CN=CC=C2)C3=CN=CC=C3)S(=O)(=O)C4=CC=C(C=C4)OC)C(=O)O)N

Isomeric SMILES

CC1=C(C(=C(C(=C1CC2=CN=CC=C2)C3=CN=CC=C3)S(=O)(=O)C4=CC=C(C=C4)OC)C(=O)O)N

InChI

InChI=1S/C26H23N3O5S/c1-16-21(13-17-5-3-11-28-14-17)22(18-6-4-12-29-15-18)25(23(24(16)27)26(30)31)35(32,33)20-9-7-19(34-2)8-10-20/h3-12,14-15H,13,27H2,1-2H3,(H,30,31)