Vitas-M small molecule compound

4-amino-6-methyl-3-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-1,2,4-triazin-5(4H)-one

Catalog ID
STK807878
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])CSc1nnc(c(=O)n1N)C

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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 C12H11N5O4S MW 321.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N5O4S/c1-7-11(19)16(13)12(15-14-7)22-6-10(18)8-2-4-9(5-3-8)17(20)21/h2-5H,6,13H2,1H3
InChIKey
YRJXRMGEWISJAF-UHFFFAOYSA-N
Synonyms
897830-90-9
4amino6methyl3((2(4nitrophenyl)2oxoethyl)sulfanyl)124triazin5(4H)one
4AMINO6METHYL3((2(4NITROPHENYL)2OXOETHYL)THIO)124TRIAZIN5(4H)ONE
4AMINO6METHYL3(2(4NITROPHENYL)2OXOETHYL)SULFANYL124TRIAZIN5ONE
4AMINO6METHYL3(2(4NITROPHENYL)2OXOETHYLTHIO)124TRIAZIN5ONE
897830909
CC1=NN=C(N(C1=O)N)SCC(=O)C2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC12H11N5O4Sc1711(19)16(13)12(15147)22610(18)8249(538)17(20)21h25H613H21H3
MFCD06750965
O=C(c1ccc(cc1)(N+)(=O)(O))CSc1nnc(c(=O)n1N)C
ZINC000004942539
ZINC04942539
ZINC4942539

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Available files

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