Vitas-M small molecule compound
2-[(7-oxo-7,11-dihydro-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclohexan]-9-yl)sulfanyl]acetamide
Catalog ID
STL045968
SMILES NC(=O)CSc1n[nH]c2n1c(=O)c1c(n2)c2ccccc2CC21CCCCC2
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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 C20H21N5O2S MW 395.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O2S/c21-14(26)11-28-19-24-23-18-22-16-13-7-3-2-6-12(13)10-20(8-4-1-5-9-20)15(16)17(27)25(18)19/h2-3,6-7H,1,4-5,8-11H2,(H2,21,26)(H,22,23)InChIKey
JOMMBPHIXQDUSJ-UHFFFAOYSA-NSynonyms
573935-86-12((7oxo711dihydro5Hspiro(benzo(h)(124)triazolo(34b)quinazoline61cyclohexan)9yl)sulfanyl)acetamide
573935861
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N5C(=N4)NN=C5SCC(=O)N
InChI=1SC20H21N5O2Sc2114(26)112819242318221613732612(13)1020(8415920)15(16)17(27)25(18)19h2367H145811H2(H22126)(H2223)
MFCD04078684
NC(=O)CSc1n(nH)c2n1c(=O)c1c(n2)c2ccccc2CC21CCCCC2
ZINC000101058749
ZINC101058749
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