2-[2-[(4-chlorophenyl)-(phenylsulfonyl)amino]ethanoylamino]-3-[[2-[2-[(4-chlorophenyl)-(phenylsulfonyl)amino]ethanoylamino]-3-oxidanyl-3-oxidanylidene-propyl]disulfanyl]propanoic acid

Systemtic Name: 2-[2-[(4-chlorophenyl)-(phenylsulfonyl)amino]ethanoylamino]-3-[[2-[2-[(4-chlorophenyl)-(phenylsulfonyl)amino]ethanoylamino]-3-oxidanyl-3-oxidanylidene-propyl]disulfanyl]propanoic acid Openeye Name: 2-[[2-[N-(benzenesulfonyl)-4-chloro-anilino]acetyl]amino]-3-[[2-[[2-[N-(benzenesulfonyl)-4-chloro-anilino]acetyl]amino]-3-hydroxy-3-oxo-propyl]disulfanyl]propanoic acid CAS Name: 2-[[2-[N-(benzenesulfonyl)-4-chloroanilino]-1-oxoethyl]amino]-3-[[2-[[2-[N-(benzenesulfonyl)-4-chloroanilino]-1-oxoethyl]amino]-3-hydroxy-3-oxopropyl]disulfanyl]propanoic acid IUPAC Name: 2-[[2-[N-(benzenesulfonyl)-4-chloroanilino]acetyl]amino]-3-[[2-[[2-[N-(benzenesulfonyl)-4-chloroanilino]acetyl]amino]-3-hydroxy-3-oxopropyl]disulfanyl]propanoic acid Traditional Name: 2-[[2-(N-besyl-4-chloro-anilino)acetyl]amino]-3-[[2-[[2-(N-besyl-4-chloro-anilino)acetyl]amino]-3-hydroxy-3-keto-propyl]disulfanyl]propionic acid Formula: C34H32Cl2N4O10S4 MolecularWeight: 855.80468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC(CSSCC(C(=O)O)NC(=O)CN(C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3)C(=O)O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC(CSSCC(C(=O)O)NC(=O)CN(C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3)C(=O)O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C34H32Cl2N4O10S4/c35-23-11-15-25(16-12-23)39(53(47,48)27-7-3-1-4-8-27)19-31(41)37-29(33(43)44)21-51-52-22-30(34(45)46)38-32(42)20-40(26-17-13-24(36)14-18-26)54(49,50)28-9-5-2-6-10-28/h1-18,29-30H,19-22H2,(H,37,41)(H,38,42)(H,43,44)(H,45,46)