Vitas-M small molecule compound
2-{5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK305849
SMILES [O-][N+](=O)c1cnn(c1)Cc1ccc(o1)c1nn2c(n1)c1c(nc2)sc2c1CCCC2
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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 C19H15N7O3S MW 421.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N7O3S/c27-26(28)11-7-21-24(8-11)9-12-5-6-14(29-12)17-22-18-16-13-3-1-2-4-15(13)30-19(16)20-10-25(18)23-17/h5-8,10H,1-4,9H2InChIKey
AOHPHDHOXUMCRA-UHFFFAOYSA-NSynonyms
1005697-52-8(O)(N+)(=O)c1cnn(c1)Cc1ccc(o1)c1nn2c(n1)c1c(nc2)sc2c1CCCC2
1005697528
2(5((4nitro1Hpyrazol1yl)methyl)furan2yl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
C1CCC2=C(C1)C3=C(S2)N=CN4C3=NC(=N4)C5=CC=C(O5)CN6C=C(C=N6)(N+)(=O)(O)
InChI=1SC19H15N7O3Sc2726(28)1172124(811)9125614(2912)1722181613312415(13)3019(16)201025(18)2317h5810H149H2
MFCD04046638
ZINC000002787791
ZINC02787791
ZINC2787791
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