Vitas-M small molecule compound
1-(methylsulfanyl)-4-phenyl-7,8,9,10-tetrahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK830729
SMILES CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCCC3
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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 C19H18N4OS2 MW 382.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4OS2/c1-25-19-21-20-18-22(12-8-4-2-5-9-12)16(24)15-13-10-6-3-7-11-14(13)26-17(15)23(18)19/h2,4-5,8-9H,3,6-7,10-11H2,1H3InChIKey
QQDGCGCNWLOYII-UHFFFAOYSA-NSynonyms
371948-38-81(methylsulfanyl)4phenyl78910tetrahydro6Hcyclohepta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(methylthio)4phenyl78910tetrahydro4Hcyclohepta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(6H)one
371948388
CSC1=NN=C2N1C3=C(C4=C(S3)CCCCC4)C(=O)N2C5=CC=CC=C5
InChI=1SC19H18N4OS2c1251921201822(128425912)16(24)1513106371114(13)2617(15)23(18)19h24589H3671011H21H3
MFCD01874828
ZINC000001208585
ZINC01208585
ZINC1208585
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