Vitas-M small molecule compound

10-ethyl-10-methyl-3-[(4-nitrobenzyl)sulfanyl]-5-(propylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine

Catalog ID
STK555307
SMILES CCCSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)[N+](=O)[O-])nn2)CC(OC3)(C)CC

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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 C23H25N5O3S3 MW 515.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O3S3/c1-4-10-32-21-24-20-18(16-11-23(3,5-2)31-12-17(16)34-20)19-25-26-22(27(19)21)33-13-14-6-8-15(9-7-14)28(29)30/h6-9H,4-5,10-13H2,1-3H3
InChIKey
JWHROAOPDHMKPB-UHFFFAOYSA-N
Synonyms
676157-10-1
10ethyl10methyl3((4nitrobenzyl)sulfanyl)5(propylsulfanyl)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
10ethyl10methyl3((4nitrobenzyl)thio)5(propylthio)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
676157101
CCCSC1=NC2=C(C3=C(S2)COC(C3)(C)CC)C4=NN=C(N41)SCC5=CC=C(C=C5)(N+)(=O)(O)
CCCSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)(N+)(=O)(O))nn2)CC(OC3)(C)CC
InChI=1SC23H25N5O3S3c14103221242018(161123(352)311217(16)3420)19252622(27(19)21)3313146815(9714)28(29)30h69H451013H213H3
MFCD04010331
ZINC000001860967
ZINC000001860968

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Available files

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