Vitas-M small molecule compound
4-(4-chlorophenyl)-1-[(4-nitrobenzyl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK720485
SMILES Clc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SCc1ccc(cc1)[N+](=O)[O-]
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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 C24H18ClN5O3S2 MW 524.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClN5O3S2/c25-15-7-11-16(12-8-15)28-21(31)20-18-3-1-2-4-19(18)35-22(20)29-23(28)26-27-24(29)34-13-14-5-9-17(10-6-14)30(32)33/h5-12H,1-4,13H2InChIKey
GUIFBKNQZIMQTN-UHFFFAOYSA-NSynonyms
674330-26-84(4chlorophenyl)1((4nitrobenzyl)sulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4(4chlorophenyl)1((4nitrobenzyl)thio)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
674330268
C1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC5=CC=C(C=C5)(N+)(=O)(O))N(C3=O)C6=CC=C(C=C6)Cl
Clc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H18ClN5O3S2c251571116(12815)2821(31)2018312419(18)3522(20)2923(28)262724(29)3413145917(10614)30(32)33h512H1413H2
MFCD04007369
ZINC000001865255
ZINC01865255
ZINC1865255
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