Vitas-M small molecule compound
3-methyl-1-(1H-tetrazol-5-ylmethoxy)-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Catalog ID
STK717625
SMILES Cc1cc(OCc2nnn[nH]2)c2c(c1)oc(=O)c1c2CCCC1
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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 C16H16N4O3 MW 312.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O3/c1-9-6-12(22-8-14-17-19-20-18-14)15-10-4-2-3-5-11(10)16(21)23-13(15)7-9/h6-7H,2-5,8H2,1H3,(H,17,18,19,20)InChIKey
TVPKALLWKKKSBI-UHFFFAOYSA-NSynonyms
896076-57-61((1Htetrazol5yl)methoxy)3methyl78910tetrahydro6Hbenzo(c)chromen6one
3methyl1(1Htetrazol5ylmethoxy)78910tetrahydro6Hbenzo(c)chromen6one
3methyl1(2Htetrazol5ylmethoxy)78910tetrahydrobenzo(c)chromen6one
896076576
CC1=CC2=C(C3=C(CCCC3)C(=O)O2)C(=C1)OCC4=NNN=N4
Cc1cc(OCc2nnn(nH)2)c2c(c1)oc(=O)c1c2CCCC1
InChI=1SC16H16N4O3c19612(228141719201814)1510423511(10)16(21)2313(15)79h67H258H21H3(H17181920)
MFCD06592718
ZINC000004295086
ZINC4295086
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