Vitas-M small molecule compound

2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl {2,2,2-trichloro-1-[(2-chlorobenzyl)amino]ethyl}carbamate

Catalog ID
STK788500
SMILES O=C(NC(C(Cl)(Cl)Cl)NCc1ccccc1Cl)OCCn1c(C)ncc1[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H17Cl4N5O4 MW 485.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17Cl4N5O4/c1-10-21-9-13(25(27)28)24(10)6-7-29-15(26)23-14(16(18,19)20)22-8-11-4-2-3-5-12(11)17/h2-5,9,14,22H,6-8H2,1H3,(H,23,26)
InChIKey
GDTROMIWQVPIEM-UHFFFAOYSA-N
Synonyms
301157-47-1
(2(2METHYL5NITROIMIDAZOLYL)ETHOXY)N(222TRICHLORO1(((2CHLOROPHENYL)METHYL)AMINO)ETHYL)CARBOXAMIDE
(222TRICHLORO1(2CHLOROBENZYLAMINO)ETHYL)CARBAMICACID2(2METHYL5NITROIMIDAZOL1YL)ETHYLESTER
2(2methyl5nitro1Himidazol1yl)ethyl(222trichloro1((2chlorobenzyl)amino)ethyl)carbamate
2(2METHYL5NITROIMIDAZOL1YL)ETHYLN(222TRICHLORO1((2CHLOROPHENYL)METHYLAMINO)ETHYL)CARBAMATE
301157471
CC1=NC=C(N1CCOC(=O)NC(C(Cl)(Cl)Cl)NCC2=CC=CC=C2Cl)(N+)(=O)(O)
InChI=1SC16H17Cl4N5O4c11021913(25(27)28)24(10)672915(26)2314(16(1819)20)22811423512(11)17h2591422H68H21H3(H2326)
MFCD00620620
O=C(NC(C(Cl)(Cl)Cl)NCc1ccccc1Cl)OCCn1c(C)ncc1(N+)(=O)(O)
ZINC000012564796
ZINC000012564797

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Available files

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