Vitas-M small molecule compound
1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-(3-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK538854
SMILES Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCCC3
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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 C26H21ClN4O2S2 MW 521.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN4O2S2/c1-15-5-4-6-18(13-15)30-23(33)22-19-7-2-3-8-21(19)35-24(22)31-25(30)28-29-26(31)34-14-20(32)16-9-11-17(27)12-10-16/h4-6,9-13H,2-3,7-8,14H2,1H3InChIKey
UHPTWZGWUKGYRN-UHFFFAOYSA-NSynonyms
383904-13-01((2(4chlorophenyl)2oxoethyl)sulfanyl)4(3methylphenyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((2(4chlorophenyl)2oxoethyl)thio)4(mtolyl)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
383904130
CC1=CC(=CC=C1)N2C(=O)C3=C(N4C2=NN=C4SCC(=O)C5=CC=C(C=C5)Cl)SC6=C3CCCC6
InChI=1SC26H21ClN4O2S2c11554618(1315)3023(33)2219723821(19)3524(22)3125(30)282926(31)341420(32)1691117(27)121016h46913H237814H21H3
MFCD03284008
ZINC000001825081
ZINC01825081
ZINC1825081
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