3-[(4-tert-butylphenyl)sulfonylamino]-N-(cyanomethyl)-5-(2-hydroxyethyloxy)-4-(2-methoxyphenoxy)benzamide

Systemtic Name: 3-[(4-tert-butylphenyl)sulfonylamino]-N-(cyanomethyl)-5-(2-hydroxyethyloxy)-4-(2-methoxyphenoxy)benzamide Openeye Name: 3-[(4-tert-butylphenyl)sulfonylamino]-N-(cyanomethyl)-5-(2-hydroxyethoxy)-4-(2-methoxyphenoxy)benzamide CAS Name: 3-[(4-tert-butylphenyl)sulfonylamino]-N-(cyanomethyl)-5-(2-hydroxyethoxy)-4-(2-methoxyphenoxy)benzamide IUPAC Name: 3-[(4-tert-butylphenyl)sulfonylamino]-N-(cyanomethyl)-5-(2-hydroxyethoxy)-4-(2-methoxyphenoxy)benzamide Traditional Name: 3-[(4-tert-butylphenyl)sulfonylamino]-N-(cyanomethyl)-5-(2-hydroxyethoxy)-4-(2-methoxyphenoxy)benzamide Formula: C28H31N3O7S MolecularWeight: 553.62664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=CC(=C2)C(=O)NCC#N)OCCO)OC3=CC=CC=C3OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=CC(=C2)C(=O)NCC#N)OCCO)OC3=CC=CC=C3OC

InChI

InChI=1S/C28H31N3O7S/c1-28(2,3)20-9-11-21(12-10-20)39(34,35)31-22-17-19(27(33)30-14-13-29)18-25(37-16-15-32)26(22)38-24-8-6-5-7-23(24)36-4/h5-12,17-18,31-32H,14-16H2,1-4H3,(H,30,33)