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

Systemtic Name: 2-[4-[2-ethyl-5-(1-hydroxyethyl)benzimidazol-1-yl]phenyl]ethyl-(4-methylphenyl)sulfonyl-carbamic acid Openeye Name: 2-[4-[2-ethyl-5-(1-hydroxyethyl)benzimidazol-1-yl]phenyl]ethyl-(p-tolylsulfonyl)carbamic acid CAS Name: 2-[4-[2-ethyl-5-(1-hydroxyethyl)-1-benzimidazolyl]phenyl]ethyl-(4-methylphenyl)sulfonylcarbamic acid IUPAC Name: 2-[4-[2-ethyl-5-(1-hydroxyethyl)benzimidazol-1-yl]phenyl]ethyl-(4-methylphenyl)sulfonylcarbamic acid Traditional Name: 2-[4-[2-ethyl-5-(1-hydroxyethyl)benzimidazol-1-yl]phenyl]ethyl-tosyl-carbamic acid Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=CC=C(C=C3)CCN(C(=O)O)S(=O)(=O)C4=CC=C(C=C4)C)C=CC(=C2)C(C)O

Isomeric SMILES

CCC1=NC2=C(N1C3=CC=C(C=C3)CCN(C(=O)O)S(=O)(=O)C4=CC=C(C=C4)C)C=CC(=C2)C(C)O

InChI

InChI=1S/C27H29N3O5S/c1-4-26-28-24-17-21(19(3)31)9-14-25(24)30(26)22-10-7-20(8-11-22)15-16-29(27(32)33)36(34,35)23-12-5-18(2)6-13-23/h5-14,17,19,31H,4,15-16H2,1-3H3,(H,32,33)