cyclopropylmethyl 3-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-3-oxidanyl-3-phenyl-propanoate

Systemtic Name: cyclopropylmethyl 3-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-3-oxidanyl-3-phenyl-propanoate Openeye Name: cyclopropylmethyl 3-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-3-hydroxy-3-phenyl-propanoate CAS Name: 3-(2-amino-3-propan-2-ylsulfonyl-5-benzimidazolyl)-3-hydroxy-3-phenylpropanoic acid cyclopropylmethyl ester IUPAC Name: cyclopropylmethyl 3-(2-amino-3-propan-2-ylsulfonylbenzimidazol-5-yl)-3-hydroxy-3-phenylpropanoate Traditional Name: 3-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-3-hydroxy-3-phenyl-propionic acid cyclopropylmethyl ester Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C(CC(=O)OCC3CC3)(C4=CC=CC=C4)O)N=C1N

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C(CC(=O)OCC3CC3)(C4=CC=CC=C4)O)N=C1N

InChI

InChI=1S/C23H27N3O5S/c1-15(2)32(29,30)26-20-12-18(10-11-19(20)25-22(26)24)23(28,17-6-4-3-5-7-17)13-21(27)31-14-16-8-9-16/h3-7,10-12,15-16,28H,8-9,13-14H2,1-2H3,(H2,24,25)