Vitas-M small molecule compound

2-[(6-amino-5-nitropyrimidin-4-yl)amino]ethyl [(4-methylphenyl)sulfonyl]carbamate

Catalog ID
STK944489
SMILES O=C(NS(=O)(=O)c1ccc(cc1)C)OCCNc1ncnc(c1[N+](=O)[O-])N

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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 C14H16N6O6S MW 396.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N6O6S/c1-9-2-4-10(5-3-9)27(24,25)19-14(21)26-7-6-16-13-11(20(22)23)12(15)17-8-18-13/h2-5,8H,6-7H2,1H3,(H,19,21)(H3,15,16,17,18)
InChIKey
NJKLIZLTLOGXMR-UHFFFAOYSA-N
Synonyms
717120-40-6
(2((6AMINO5NITROPYRIMIDIN4YL)AMINO)ETHOXY)N((4METHYLPHENYL)SULFONYL)CARBOXAMIDE
2((6amino5nitropyrimidin4yl)amino)ethyl((4methylphenyl)sulfonyl)carbamate
2((6AMINO5NITROPYRIMIDIN4YL)AMINO)ETHYLN(4METHYLPHENYL)SULFONYLCARBAMATE
717120406
CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OCCNC2=NC=NC(=C2(N+)(=O)(O))N
InChI=1SC14H16N6O6Sc192410(539)27(2425)1914(21)2676161311(20(22)23)12(15)1781813h258H67H21H3(H1921)(H315161718)
MFCD06327769
O=C(NS(=O)(=O)c1ccc(cc1)C)OCCNc1ncnc(c1(N+)(=O)(O))N
ZINC000009097282
ZINC9097282

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Available files

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