4-azanyl-5-oxidanylidene-5-[[1-oxidanylidene-1-[(2-oxidanylidene-2-phenoxy-ethyl)amino]-3-(phenylmethylsulfanyl)propan-2-yl]amino]pentanoic acid

Systemtic Name: 4-azanyl-5-oxidanylidene-5-[[1-oxidanylidene-1-[(2-oxidanylidene-2-phenoxy-ethyl)amino]-3-(phenylmethylsulfanyl)propan-2-yl]amino]pentanoic acid Openeye Name: 4-amino-5-[[1-(benzylsulfanylmethyl)-2-oxo-2-[(2-oxo-2-phenoxy-ethyl)amino]ethyl]amino]-5-oxo-pentanoic acid CAS Name: 4-amino-5-oxo-5-[[1-oxo-1-[(2-oxo-2-phenoxyethyl)amino]-3-(phenylmethylthio)propan-2-yl]amino]pentanoic acid IUPAC Name: 4-amino-5-[[3-benzylsulfanyl-1-oxo-1-[(2-oxo-2-phenoxyethyl)amino]propan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 4-amino-5-[[1-[(benzylthio)methyl]-2-keto-2-[(2-keto-2-phenoxy-ethyl)amino]ethyl]amino]-5-keto-valeric acid Formula: C23H27N3O6S MolecularWeight: 473.54198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(C(=O)NCC(=O)OC2=CC=CC=C2)NC(=O)C(CCC(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CSCC(C(=O)NCC(=O)OC2=CC=CC=C2)NC(=O)C(CCC(=O)O)N

InChI

InChI=1S/C23H27N3O6S/c24-18(11-12-20(27)28)22(30)26-19(15-33-14-16-7-3-1-4-8-16)23(31)25-13-21(29)32-17-9-5-2-6-10-17/h1-10,18-19H,11-15,24H2,(H,25,31)(H,26,30)(H,27,28)