2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[2-(2-benzotriazolyl)-4-methylphenoxy]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[2-(benzotriazol-2-yl)-4-methylphenoxy]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C25H25N5O4S MolecularWeight: 491.5621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)N4N=C5C=CC=CC5=N4

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)N4N=C5C=CC=CC5=N4

InChI

InChI=1S/C25H25N5O4S/c1-18-11-12-24(23(15-18)30-27-21-9-2-3-10-22(21)28-30)34-17-25(31)26-19-7-6-8-20(16-19)35(32,33)29-13-4-5-14-29/h2-3,6-12,15-16H,4-5,13-14,17H2,1H3,(H,26,31)