ethyl 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-3-phenyl-propanoate CAS Name: 2-[[4-[(2-methyl-1-benzimidazolyl)methyl]phenyl]sulfonylamino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-3-phenylpropanoate Traditional Name: 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-3-phenyl-propionic acid ethyl ester Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)CN3C(=NC4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)CN3C(=NC4=CC=CC=C43)C

InChI

InChI=1S/C26H27N3O4S/c1-3-33-26(30)24(17-20-9-5-4-6-10-20)28-34(31,32)22-15-13-21(14-16-22)18-29-19(2)27-23-11-7-8-12-25(23)29/h4-16,24,28H,3,17-18H2,1-2H3