2-[4-[5-ethanoyl-2-(1H-pyrazol-5-yl)benzimidazol-1-yl]phenyl]ethyl-(4-methylphenyl)sulfonyl-carbamic acid

Systemtic Name: 2-[4-[5-ethanoyl-2-(1H-pyrazol-5-yl)benzimidazol-1-yl]phenyl]ethyl-(4-methylphenyl)sulfonyl-carbamic acid Openeye Name: 2-[4-[5-acetyl-2-(1H-pyrazol-5-yl)benzimidazol-1-yl]phenyl]ethyl-(p-tolylsulfonyl)carbamic acid CAS Name: 2-[4-[5-acetyl-2-(1H-pyrazol-5-yl)-1-benzimidazolyl]phenyl]ethyl-(4-methylphenyl)sulfonylcarbamic acid IUPAC Name: 2-[4-[5-acetyl-2-(1H-pyrazol-5-yl)benzimidazol-1-yl]phenyl]ethyl-(4-methylphenyl)sulfonylcarbamic acid Traditional Name: 2-[4-[5-acetyl-2-(1H-pyrazol-5-yl)benzimidazol-1-yl]phenyl]ethyl-tosyl-carbamic acid Formula: C28H25N5O5S MolecularWeight: 543.5936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=C(C=C2)N3C4=C(C=C(C=C4)C(=O)C)N=C3C5=CC=NN5)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=C(C=C2)N3C4=C(C=C(C=C4)C(=O)C)N=C3C5=CC=NN5)C(=O)O

InChI

InChI=1S/C28H25N5O5S/c1-18-3-10-23(11-4-18)39(37,38)32(28(35)36)16-14-20-5-8-22(9-6-20)33-26-12-7-21(19(2)34)17-25(26)30-27(33)24-13-15-29-31-24/h3-13,15,17H,14,16H2,1-2H3,(H,29,31)(H,35,36)