Vitas-M small molecule compound

3-[(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino]propan-1-ol

Catalog ID
STK589461
SMILES OCCCNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1

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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 C19H21N7OS MW 395.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N7OS/c27-10-4-8-20-17-16-14-7-9-25(11-13-5-2-1-3-6-13)12-15(14)28-18(16)26-19(21-17)22-23-24-26/h1-3,5-6,27H,4,7-12H2,(H,20,21,22,24)
InChIKey
HRCMQMFJYSMCMY-UHFFFAOYSA-N
Synonyms
896812-67-2
3((8benzyl6789tetrahydropyrido(4345)thieno(32e)tetrazolo(15a)pyrimidin5yl)amino)propan1ol
896812672
C1CN(CC2=C1C3=C(S2)N4C(=NN=N4)N=C3NCCCO)CC5=CC=CC=C5
InChI=1SC19H21N7OSc271048201716147925(11135213613)1215(14)2818(16)2619(2117)22232426h135627H4712H2(H20212224)
MFCD06596538
ZINC000020517492
ZINC20517492

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.