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

Systemtic Name: 2-[4-(2-ethyl-5-pyridin-2-yl-benzimidazol-1-yl)phenyl]ethyl N-(4-methylphenyl)sulfonylcarbamate Openeye Name: 2-[4-[2-ethyl-5-(2-pyridyl)benzimidazol-1-yl]phenyl]ethyl N-(p-tolylsulfonyl)carbamate CAS Name: N-(4-methylphenyl)sulfonylcarbamic acid 2-[4-[2-ethyl-5-(2-pyridinyl)-1-benzimidazolyl]phenyl]ethyl ester IUPAC Name: 2-[4-(2-ethyl-5-pyridin-2-ylbenzimidazol-1-yl)phenyl]ethyl N-(4-methylphenyl)sulfonylcarbamate Traditional Name: N-tosylcarbamic acid 2-[4-[2-ethyl-5-(2-pyridyl)benzimidazol-1-yl]phenyl]ethyl ester Formula: C30H28N4O4S MolecularWeight: 540.63272

Click to see the large picture

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=CC=CC=N5

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=CC=CC=N5

InChI

InChI=1S/C30H28N4O4S/c1-3-29-32-27-20-23(26-6-4-5-18-31-26)11-16-28(27)34(29)24-12-9-22(10-13-24)17-19-38-30(35)33-39(36,37)25-14-7-21(2)8-15-25/h4-16,18,20H,3,17,19H2,1-2H3,(H,33,35)