N-(2-methoxyphenyl)-2-[[4-(pyridin-4-ylmethyl)phenyl]amino]-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N-(2-methoxyphenyl)-2-[[4-(pyridin-4-ylmethyl)phenyl]amino]-1,3-benzoxazole-5-sulfonamide Openeye Name: N-(2-methoxyphenyl)-2-[4-(4-pyridylmethyl)anilino]-1,3-benzoxazole-5-sulfonamide CAS Name: N-(2-methoxyphenyl)-2-[4-(pyridin-4-ylmethyl)anilino]-1,3-benzoxazole-5-sulfonamide IUPAC Name: N-(2-methoxyphenyl)-2-[4-(pyridin-4-ylmethyl)anilino]-1,3-benzoxazole-5-sulfonamide Traditional Name: N-(2-methoxyphenyl)-2-[4-(4-pyridylmethyl)anilino]-1,3-benzoxazole-5-sulfonamide Formula: C26H22N4O4S MolecularWeight: 486.54228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)NC4=CC=C(C=C4)CC5=CC=NC=C5

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)NC4=CC=C(C=C4)CC5=CC=NC=C5

InChI

InChI=1S/C26H22N4O4S/c1-33-24-5-3-2-4-22(24)30-35(31,32)21-10-11-25-23(17-21)29-26(34-25)28-20-8-6-18(7-9-20)16-19-12-14-27-15-13-19/h2-15,17,30H,16H2,1H3,(H,28,29)