methyl 2-[[1-[(2-chlorophenyl)methyl]-2-[1-[[4-(oxidanylamino)-4-oxidanylidene-butanoyl]amino]-2-phenyl-ethyl]benzimidazol-5-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[1-[(2-chlorophenyl)methyl]-2-[1-[[4-(oxidanylamino)-4-oxidanylidene-butanoyl]amino]-2-phenyl-ethyl]benzimidazol-5-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[1-[(2-chlorophenyl)methyl]-2-[1-[[4-(hydroxyamino)-4-oxo-butanoyl]amino]-2-phenyl-ethyl]benzimidazole-5-carbonyl]amino]acetate CAS Name: 2-[[[1-[(2-chlorophenyl)methyl]-2-[1-[[4-(hydroxyamino)-1,4-dioxobutyl]amino]-2-phenylethyl]-5-benzimidazolyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[1-[(2-chlorophenyl)methyl]-2-[1-[[4-(hydroxyamino)-4-oxobutanoyl]amino]-2-phenylethyl]benzimidazole-5-carbonyl]amino]acetate Traditional Name: 2-[[1-(2-chlorobenzyl)-2-[1-[[4-(hydroxyamino)-4-keto-butanoyl]amino]-2-phenyl-ethyl]benzimidazole-5-carbonyl]amino]acetic acid methyl ester Formula: C30H30ClN5O6 MolecularWeight: 592.0421

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC2=C(C=C1)N(C(=N2)C(CC3=CC=CC=C3)NC(=O)CCC(=O)NO)CC4=CC=CC=C4Cl

Isomeric SMILES

COC(=O)CNC(=O)C1=CC2=C(C=C1)N(C(=N2)C(CC3=CC=CC=C3)NC(=O)CCC(=O)NO)CC4=CC=CC=C4Cl

InChI

InChI=1S/C30H30ClN5O6/c1-42-28(39)17-32-30(40)20-11-12-25-23(16-20)34-29(36(25)18-21-9-5-6-10-22(21)31)24(15-19-7-3-2-4-8-19)33-26(37)13-14-27(38)35-41/h2-12,16,24,41H,13-15,17-18H2,1H3,(H,32,40)(H,33,37)(H,35,38)