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N-(3,4-Dichlorophenyl)-N'-(1-isopropyl-4,5-dioxoimidazolidin-2-ylidene)-N"-[isobutyloxycarbonyl]-guanidine
SpectraBase Compound ID 4XyV7niKJGA
InChI InChI=1S/C18H21Cl2N5O4/c1-9(2)8-29-18(28)24-16(21-11-5-6-12(19)13(20)7-11)23-17-22-14(26)15(27)25(17)10(3)4/h5-7,9-10H,8H2,1-4H3,(H2,21,22,23,24,26,28)
InChIKey NTXJUVUKBFKFRU-UHFFFAOYSA-N
Mol Weight 442.3 g/mol
Molecular Formula C18H21Cl2N5O4
Exact Mass 441.09706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E1plxogug2M
Name N-(3,4-Dichlorophenyl)-N'-(1-isopropyl-4,5-dioxoimidazolidin-2-ylidene)-N"-[isobutyloxycarbonyl]-guanidine
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Formula C18H21Cl2N5O4
InChI InChI=1S/C18H21Cl2N5O4/c1-9(2)8-29-18(28)24-16(21-11-5-6-12(19)13(20)7-11)23-17-22-14(26)15(27)25(17)10(3)4/h5-7,9-10H,8H2,1-4H3,(H2,21,22,23,24,26,28)
InChIKey NTXJUVUKBFKFRU-UHFFFAOYSA-N
Molecular Weight 442.303 g/mol
SMILES N1C(C(N(\C1=N\C(=N/C(=O)OCC(C)C)Nc1cc(Cl)c(cc1)Cl)C(C)C)=O)=O
SPLASH splash10-000i-0309300000-dc1253c93547e8ca1917
Source of Spectrum AF-48-6477-1b
Synonyms (NZ)-N-[(3,4-dichloroanilino)-[(4,5-dioxo-1-propan-2-yl-2-imidazolyl)amino]methylidene]carbamic acid 2-methylpropyl ester 2-Methylpropyl (NZ)-N-[(3,4-dichloroanilino)-[(4,5-dioxo-1-propan-2-ylimidazol-2-yl)amino]methylidene]carbamate isobutyl (NZ)-N-[(3,4-dichloroanilino)-[(1-isopropyl-4,5-dioxo-imidazol-2-yl)amino]methylene]carbamate 2-Methylpropyl (NZ)-N-[[[4,5-bis(oxidanylidene)-1-propan-2-yl-imidazol-2-yl]amino]-[(3,4-dichlorophenyl)amino]methylidene]carbamate
Wiley ID 1694036