(2R)-3-(1H-indol-3-yl)-2-[(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]propanoate

Systemtic Name: (2R)-3-(1H-indol-3-yl)-2-[(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]propanoate Openeye Name: (2R)-3-(1H-indol-3-yl)-2-[(2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoyl)amino]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[[2-methyl-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]propanoate IUPAC Name: (2R)-3-(1H-indol-3-yl)-2-[(2-methyl-5-pyrrolidin-1-ylsulfonylbenzoyl)amino]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[(2-methyl-5-pyrrolidinosulfonyl-benzoyl)amino]propionate Formula: C23H24N3O5S- MolecularWeight: 454.51876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N[C@H](CC3=CNC4=CC=CC=C43)C(=O)[O-]

InChI

InChI=1S/C23H25N3O5S/c1-15-8-9-17(32(30,31)26-10-4-5-11-26)13-19(15)22(27)25-21(23(28)29)12-16-14-24-20-7-3-2-6-18(16)20/h2-3,6-9,13-14,21,24H,4-5,10-12H2,1H3,(H,25,27)(H,28,29)/p-1/t21-/m1/s1