Vitas-M small molecule compound
3-methyl-2-(1H-tetrazol-5-ylmethoxy)-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Catalog ID
STK717628
SMILES Cc1cc2oc(=O)c3c(c2cc1OCc1nnn[nH]1)CCCC3
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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/c1-9-6-14-12(7-13(9)22-8-15-17-19-20-18-15)10-4-2-3-5-11(10)16(21)23-14/h6-7H,2-5,8H2,1H3,(H,17,18,19,20)InChIKey
DDTOMQMRYLXSBF-UHFFFAOYSA-NSynonyms
899396-39-52((1Htetrazol5yl)methoxy)3methyl78910tetrahydro6Hbenzo(c)chromen6one
3methyl2(1Htetrazol5ylmethoxy)78910tetrahydro6Hbenzo(c)chromen6one
3methyl2(2Htetrazol5ylmethoxy)78910tetrahydrobenzo(c)chromen6one
899396395
CC1=C(C=C2C3=C(CCCC3)C(=O)OC2=C1)OCC4=NNN=N4
Cc1cc2oc(=O)c3c(c2cc1OCc1nnn(nH)1)CCCC3
InChI=1SC16H16N4O3c1961412(713(9)228151719201815)10423511(10)16(21)2314h67H258H21H3(H17181920)
MFCD06606945
ZINC000004283049
ZINC4283049
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