(phenylmethyl) N-[(2S)-4-methyl-1-[3-[[(2R)-4-methyl-2-(quinolin-2-ylcarbonylamino)pentanoyl]amino]pyrrolidin-1-yl]pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-4-methyl-1-[3-[[(2R)-4-methyl-2-(quinolin-2-ylcarbonylamino)pentanoyl]amino]pyrrolidin-1-yl]pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-3-methyl-1-[[3-[[(2R)-4-methyl-2-(quinoline-2-carbonylamino)pentanoyl]amino]pyrrolidin-1-yl]methyl]butyl]carbamate CAS Name: N-[(2S)-4-methyl-1-[3-[[(2R)-4-methyl-1-oxo-2-[[oxo(2-quinolinyl)methyl]amino]pentyl]amino]-1-pyrrolidinyl]pentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-4-methyl-1-[3-[[(2R)-4-methyl-2-(quinoline-2-carbonylamino)pentanoyl]amino]pyrrolidin-1-yl]pentan-2-yl]carbamate Traditional Name: N-[(1S)-3-methyl-1-[[3-[[(2R)-4-methyl-2-(quinaldoylamino)pentanoyl]amino]pyrrolidino]methyl]butyl]carbamic acid benzyl ester Formula: C34H45N5O4 MolecularWeight: 587.7522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CN1CCC(C1)NC(=O)C(CC(C)C)NC(=O)C2=NC3=CC=CC=C3C=C2)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)C[C@@H](CN1CCC(C1)NC(=O)[C@@H](CC(C)C)NC(=O)C2=NC3=CC=CC=C3C=C2)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C34H45N5O4/c1-23(2)18-28(36-34(42)43-22-25-10-6-5-7-11-25)21-39-17-16-27(20-39)35-33(41)31(19-24(3)4)38-32(40)30-15-14-26-12-8-9-13-29(26)37-30/h5-15,23-24,27-28,31H,16-22H2,1-4H3,(H,35,41)(H,36,42)(H,38,40)/t27?,28-,31+/m0/s1