N,N'-bis[1-[[1-[[6-[bis(azanyl)methylideneamino]-1-chloranyl-2-oxidanylidene-hexan-3-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-2,3-bis(oxidanyl)butanediamide

Systemtic Name: N,N'-bis[1-[[1-[[6-[bis(azanyl)methylideneamino]-1-chloranyl-2-oxidanylidene-hexan-3-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-2,3-bis(oxidanyl)butanediamide Openeye Name: N,N'-bis[1-benzyl-2-[[1-benzyl-2-[[1-(2-chloroacetyl)-4-guanidino-butyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]-2,3-dihydroxy-butanediamide CAS Name: N,N'-bis[1-[[1-[[1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-2,3-dihydroxybutanediamide IUPAC Name: N,N'-bis[1-[[1-[[1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-2,3-dihydroxybutanediamide Traditional Name: N,N'-bis[1-benzyl-2-[[1-benzyl-2-[[1-(2-chloroacetyl)-4-guanidino-butyl]amino]-2-keto-ethyl]amino]-2-keto-ethyl]-2,3-dihydroxy-succinamide Formula: C54H68Cl2N12O10 MolecularWeight: 1116.09812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CCCN=C(N)N)C(=O)CCl)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(C(C(=O)NC(CC3=CC=CC=C3)C(=O)NC(CC4=CC=CC=C4)C(=O)NC(CCCN=C(N)N)C(=O)CCl)O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC(CCCN=C(N)N)C(=O)CCl)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(C(C(=O)NC(CC3=CC=CC=C3)C(=O)NC(CC4=CC=CC=C4)C(=O)NC(CCCN=C(N)N)C(=O)CCl)O)O

InChI

InChI=1S/C54H68Cl2N12O10/c55-31-43(69)37(23-13-25-61-53(57)58)63-47(73)39(27-33-15-5-1-6-16-33)65-49(75)41(29-35-19-9-3-10-20-35)67-51(77)45(71)46(72)52(78)68-42(30-36-21-11-4-12-22-36)50(76)66-40(28-34-17-7-2-8-18-34)48(74)64-38(44(70)32-56)24-14-26-62-54(59)60/h1-12,15-22,37-42,45-46,71-72H,13-14,23-32H2,(H,63,73)(H,64,74)(H,65,75)(H,66,76)(H,67,77)(H,68,78)(H4,57,58,61)(H4,59,60,62)