Vitas-M small molecule compound
4-benzyl-1-(heptylsulfanyl)-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK721045
SMILES CCCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CC(OC3)C(C)C
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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 C27H34N4O2S2 MW 510.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O2S2/c1-4-5-6-7-11-14-34-27-29-28-26-30(16-19-12-9-8-10-13-19)24(32)23-20-15-21(18(2)3)33-17-22(20)35-25(23)31(26)27/h8-10,12-13,18,21H,4-7,11,14-17H2,1-3H3InChIKey
WHLMKAUWOHWZMX-UHFFFAOYSA-NSynonyms
371213-99-9371213999
4benzyl1(heptylsulfanyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4benzyl1(heptylthio)7isopropyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CCCCCCCSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)C(C)C)C(=O)N2CC5=CC=CC=C5
InChI=1SC27H34N4O2S2c145671114342729282630(16191298101319)24(32)23201521(18(2)3)331722(20)3525(23)31(26)27h81012131821H47111417H213H3
MFCD03010103
ZINC000001902132
ZINC000001902133
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