Vitas-M small molecule compound
5-methyl-2-(3-nitrophenyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK577450
SMILES [O-][N+](=O)c1cccc(c1)c1nn2c(n1)c1c(nc2C)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 C18H15N5O2S MW 365.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N5O2S/c1-10-19-18-15(13-7-2-3-8-14(13)26-18)17-20-16(21-22(10)17)11-5-4-6-12(9-11)23(24)25/h4-6,9H,2-3,7-8H2,1H3InChIKey
WLWZUMQYHFDVPV-UHFFFAOYSA-NSynonyms
896857-13-9(O)(N+)(=O)c1cccc(c1)c1nn2c(n1)c1c(nc2C)sc2c1CCCC2
5methyl2(3nitrophenyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
5methyl2(3nitrophenyl)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(15c)pyrimidine
896857139
CC1=NC2=C(C3=C(S2)CCCC3)C4=NC(=NN14)C5=CC(=CC=C5)(N+)(=O)(O)
InChI=1SC18H15N5O2Sc110191815(13723814(13)2618)172016(2122(10)17)1154612(911)23(24)25h469H2378H21H3
MFCD06603637
ZINC000002240926
ZINC02240926
ZINC2240926
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