(phenylmethyl) (3S)-3-[[(2S)-2-(methylamino)hexanoyl]amino]-4-[[(2S)-1-(methylamino)-3-naphthalen-1-yl-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) (3S)-3-[[(2S)-2-(methylamino)hexanoyl]amino]-4-[[(2S)-1-(methylamino)-3-naphthalen-1-yl-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: benzyl (3S)-3-[[(2S)-2-(methylamino)hexanoyl]amino]-4-[[(1S)-2-(methylamino)-1-(1-naphthylmethyl)-2-oxo-ethyl]amino]-4-oxo-butanoate CAS Name: (3S)-4-[[(2S)-1-(methylamino)-3-(1-naphthalenyl)-1-oxopropan-2-yl]amino]-3-[[(2S)-2-(methylamino)-1-oxohexyl]amino]-4-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-3-[[(2S)-2-(methylamino)hexanoyl]amino]-4-[[(2S)-1-(methylamino)-3-naphthalen-1-yl-1-oxopropan-2-yl]amino]-4-oxobutanoate Traditional Name: (3S)-4-keto-4-[[(1S)-2-keto-2-(methylamino)-1-(1-naphthylmethyl)ethyl]amino]-3-[[(2S)-2-(methylamino)hexanoyl]amino]butyric acid benzyl ester Formula: C32H40N4O5 MolecularWeight: 560.6838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(CC(=O)OCC1=CC=CC=C1)C(=O)NC(CC2=CC=CC3=CC=CC=C32)C(=O)NC)NC

Isomeric SMILES

CCCC[C@@H](C(=O)N[C@@H](CC(=O)OCC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=CC3=CC=CC=C32)C(=O)NC)NC

InChI

InChI=1S/C32H40N4O5/c1-4-5-18-26(33-2)31(39)36-28(20-29(37)41-21-22-12-7-6-8-13-22)32(40)35-27(30(38)34-3)19-24-16-11-15-23-14-9-10-17-25(23)24/h6-17,26-28,33H,4-5,18-21H2,1-3H3,(H,34,38)(H,35,40)(H,36,39)/t26-,27-,28-/m0/s1