2-[4-(2-ethyl-5-pyrimidin-5-yl-benzimidazol-1-yl)phenyl]ethyl N-(4-methylphenyl)sulfonylcarbamate

Systemtic Name: 2-[4-(2-ethyl-5-pyrimidin-5-yl-benzimidazol-1-yl)phenyl]ethyl N-(4-methylphenyl)sulfonylcarbamate Openeye Name: 2-[4-(2-ethyl-5-pyrimidin-5-yl-benzimidazol-1-yl)phenyl]ethyl N-(p-tolylsulfonyl)carbamate CAS Name: N-(4-methylphenyl)sulfonylcarbamic acid 2-[4-[2-ethyl-5-(5-pyrimidinyl)-1-benzimidazolyl]phenyl]ethyl ester IUPAC Name: 2-[4-(2-ethyl-5-pyrimidin-5-ylbenzimidazol-1-yl)phenyl]ethyl N-(4-methylphenyl)sulfonylcarbamate Traditional Name: N-tosylcarbamic acid 2-[4-[2-ethyl-5-(5-pyrimidyl)benzimidazol-1-yl]phenyl]ethyl ester Formula: C29H27N5O4S MolecularWeight: 541.62078

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=CC=C(C=C3)CCOC(=O)NS(=O)(=O)C4=CC=C(C=C4)C)C=CC(=C2)C5=CN=CN=C5

Isomeric SMILES

CCC1=NC2=C(N1C3=CC=C(C=C3)CCOC(=O)NS(=O)(=O)C4=CC=C(C=C4)C)C=CC(=C2)C5=CN=CN=C5

InChI

InChI=1S/C29H27N5O4S/c1-3-28-32-26-16-22(23-17-30-19-31-18-23)8-13-27(26)34(28)24-9-6-21(7-10-24)14-15-38-29(35)33-39(36,37)25-11-4-20(2)5-12-25/h4-13,16-19H,3,14-15H2,1-2H3,(H,33,35)