[4-[(2S)-2-azanyl-3-[[(2S)-1-[[(2S)-1-[(2-azanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-propyl]phenyl] hydrogen sulfate

Systemtic Name: [4-[(2S)-2-azanyl-3-[[(2S)-1-[[(2S)-1-[(2-azanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-propyl]phenyl] hydrogen sulfate Openeye Name: [4-[(2S)-2-amino-3-[[(1S)-2-[[(1S)-2-[(2-amino-2-oxo-ethyl)amino]-1-benzyl-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]amino]-3-oxo-propyl]phenyl] hydrogen sulfate CAS Name: sulfuric acid [4-[(2S)-2-amino-3-[[(2S)-1-[[(2S)-1-[(2-amino-2-oxoethyl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-oxopropyl]phenyl] ester IUPAC Name: [4-[(2S)-2-amino-3-[[(2S)-1-[[(2S)-1-[(2-amino-2-oxoethyl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-oxopropyl]phenyl] hydrogen sulfate Traditional Name: sulfuric acid [4-[(2S)-2-amino-3-[[(1S)-2-[[(1S)-2-[(2-amino-2-keto-ethyl)amino]-1-benzyl-2-keto-ethyl]amino]-2-keto-1-methyl-ethyl]amino]-3-keto-propyl]phenyl] ester Formula: C23H29N5O8S MolecularWeight: 535.57006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NCC(=O)N)NC(=O)C(CC2=CC=C(C=C2)OS(=O)(=O)O)N

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)N)NC(=O)[C@H](CC2=CC=C(C=C2)OS(=O)(=O)O)N

InChI

InChI=1S/C23H29N5O8S/c1-14(27-22(31)18(24)11-16-7-9-17(10-8-16)36-37(33,34)35)21(30)28-19(23(32)26-13-20(25)29)12-15-5-3-2-4-6-15/h2-10,14,18-19H,11-13,24H2,1H3,(H2,25,29)(H,26,32)(H,27,31)(H,28,30)(H,33,34,35)/t14-,18-,19-/m0/s1