propan-2-yl 3-[2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-[2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]ethanoylamino]-3-phenyl-propanoate Openeye Name: isopropyl 3-[[2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[2-[2-(methylsulfonylmethyl)-1-benzimidazolyl]-1-oxoethyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-[2-(mesylmethyl)benzimidazol-1-yl]acetyl]amino]-3-phenyl-propionic acid isopropyl ester Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)CN2C3=CC=CC=C3N=C2CS(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)CN2C3=CC=CC=C3N=C2CS(=O)(=O)C

InChI

InChI=1S/C23H27N3O5S/c1-16(2)31-23(28)13-19(17-9-5-4-6-10-17)25-22(27)14-26-20-12-8-7-11-18(20)24-21(26)15-32(3,29)30/h4-12,16,19H,13-15H2,1-3H3,(H,25,27)