[3-[(2R)-2-benzamido-3-oxidanylidene-3-[[(2R)-3-oxidanylidene-1-phenacylsulfanyl-butan-2-yl]amino]propyl]sulfanyl-2-oxidanylidene-propyl] nitrate

Systemtic Name: [3-[(2R)-2-benzamido-3-oxidanylidene-3-[[(2R)-3-oxidanylidene-1-phenacylsulfanyl-butan-2-yl]amino]propyl]sulfanyl-2-oxidanylidene-propyl] nitrate Openeye Name: [3-[(2R)-2-benzamido-3-oxo-3-[[(1R)-2-oxo-1-(phenacylsulfanylmethyl)propyl]amino]propyl]sulfanyl-2-oxo-propyl] nitrate CAS Name: nitric acid [3-[[(2R)-2-benzamido-3-oxo-3-[[(2R)-3-oxo-1-(phenacylthio)butan-2-yl]amino]propyl]thio]-2-oxopropyl] ester IUPAC Name: [3-[(2R)-2-benzamido-3-oxo-3-[[(2R)-3-oxo-1-phenacylsulfanylbutan-2-yl]amino]propyl]sulfanyl-2-oxopropyl] nitrate Traditional Name: nitric acid [3-[[(2R)-2-benzamido-3-keto-3-[[(1R)-2-keto-1-[(phenacylthio)methyl]propyl]amino]propyl]thio]-2-keto-propyl] ester Formula: C25H27N3O8S2 MolecularWeight: 561.62718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CSCC(=O)C1=CC=CC=C1)NC(=O)C(CSCC(=O)CO[N+](=O)[O-])NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)[C@H](CSCC(=O)C1=CC=CC=C1)NC(=O)[C@H](CSCC(=O)CO[N+](=O)[O-])NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C25H27N3O8S2/c1-17(29)21(14-38-16-23(31)18-8-4-2-5-9-18)26-25(33)22(15-37-13-20(30)12-36-28(34)35)27-24(32)19-10-6-3-7-11-19/h2-11,21-22H,12-16H2,1H3,(H,26,33)(H,27,32)/t21-,22-/m0/s1