4-(5,6-dimethyl-1H-benzo[d]imidazol-2-yl)-3,5-diiodobenzoyl Pro-(nitro)Arg dev

SpectraBase Compound ID	BPwxT7gV1yQ
InChI	InChI=1S/C28H32I2N8O6/c1-13-9-18-19(10-14(13)2)35-24(34-18)22-16(29)11-15(12-17(22)30)26(40)37-8-4-5-21(37)25(39)36-23(27(41)44-3)20(38(42)43)6-7-33-28(31)32/h9-12,20-21,23H,4-8H2,1-3H3,(H,34,35)(H,36,39)(H4,31,32,33)
InChIKey	CIPYHKHAESJACS-UHFFFAOYSA-N Google Search
Mol Weight	830.4 g/mol
Molecular Formula	C28H32I2N8O6
Exact Mass	830.053421 g/mol

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SpectraBase Spectrum ID	HPi0RwRzcEG
Name	4-(5,6-dimethyl-1H-benzo[d]imidazol-2-yl)-3,5-diiodobenzoyl Pro-(nitro)Arg dev
Alternate Name(s)	Methyl 2-(1-(4-(5,6-dimethyl-1H-benzo[d]imidazol-2-yl)-3,5-diiodobenzoyl)pyrrolidine-2-carboxamido)-5-guanidino-3-nitropentanoate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C28H32I2N8O6
InChI	InChI=1S/C28H32I2N8O6/c1-13-9-18-19(10-14(13)2)35-24(34-18)22-16(29)11-15(12-17(22)30)26(40)37-8-4-5-21(37)25(39)36-23(27(41)44-3)20(38(42)43)6-7-33-28(31)32/h9-12,20-21,23H,4-8H2,1-3H3,(H,34,35)(H,36,39)(H4,31,32,33)
InChIKey	CIPYHKHAESJACS-UHFFFAOYSA-N
Molecular Weight	830.423 g/mol
SMILES	[nH]1c2cc(c(cc2nc1-c1c(cc(C(N2C(C(NC(C(CCNC(=N)N)N(=O)=O)C(=O)OC)=O)CCC2)=O)cc1I)I)C)C
SPLASH	splash10-0002-2200190220-9a9d002330502fd7808c
Source of Spectrum	EMC-42-788-6d
Wiley ID	1735563