1-[[3-cyclohexyl-2-[2-oxidanylidene-3-(phenylcarbamoylamino)-3-propan-2-yl-pyrrolidin-1-yl]propanoyl]amino]propylboronic acid

Systemtic Name: 1-[[3-cyclohexyl-2-[2-oxidanylidene-3-(phenylcarbamoylamino)-3-propan-2-yl-pyrrolidin-1-yl]propanoyl]amino]propylboronic acid Openeye Name: 1-[[3-cyclohexyl-2-[3-isopropyl-2-oxo-3-(phenylcarbamoylamino)pyrrolidin-1-yl]propanoyl]amino]propylboronic acid CAS Name: 1-[[2-[3-[[anilino(oxo)methyl]amino]-2-oxo-3-propan-2-yl-1-pyrrolidinyl]-3-cyclohexyl-1-oxopropyl]amino]propylboronic acid IUPAC Name: 1-[[3-cyclohexyl-2-[2-oxo-3-(phenylcarbamoylamino)-3-propan-2-ylpyrrolidin-1-yl]propanoyl]amino]propylboronic acid Traditional Name: 1-[[3-cyclohexyl-2-[3-isopropyl-2-keto-3-(phenylcarbamoylamino)pyrrolidino]propanoyl]amino]propylboronic acid Formula: C26H41BN4O5 MolecularWeight: 500.43854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C(CC)NC(=O)C(CC1CCCCC1)N2CCC(C2=O)(C(C)C)NC(=O)NC3=CC=CC=C3)(O)O

Isomeric SMILES

B(C(CC)NC(=O)C(CC1CCCCC1)N2CCC(C2=O)(C(C)C)NC(=O)NC3=CC=CC=C3)(O)O

InChI

InChI=1S/C26H41BN4O5/c1-4-22(27(35)36)29-23(32)21(17-19-11-7-5-8-12-19)31-16-15-26(18(2)3,24(31)33)30-25(34)28-20-13-9-6-10-14-20/h6,9-10,13-14,18-19,21-22,35-36H,4-5,7-8,11-12,15-17H2,1-3H3,(H,29,32)(H2,28,30,34)