Vitas-M small molecule compound
4-(3-methylphenyl)-1-{[1-(morpholin-4-yl)-1-oxopropan-2-yl]sulfanyl}-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK829823
SMILES Cc1cccc(c1)n1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SC(C(=O)N1CCOCC1)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 C25H27N5O3S2 MW 509.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O3S2/c1-15-6-5-7-17(14-15)29-22(32)20-18-8-3-4-9-19(18)35-23(20)30-24(29)26-27-25(30)34-16(2)21(31)28-10-12-33-13-11-28/h5-7,14,16H,3-4,8-13H2,1-2H3InChIKey
XTWHPPYQCVYUIA-UHFFFAOYSA-NSynonyms
371118-43-31((1morpholino1oxopropan2yl)thio)4(mtolyl)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
371118433
4(3methylphenyl)1((1(morpholin4yl)1oxopropan2yl)sulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1=CC(=CC=C1)N2C(=O)C3=C(N4C2=NN=C4SC(C)C(=O)N5CCOCC5)SC6=C3CCCC6
InChI=1SC25H27N5O3S2c11565717(1415)2922(32)2018834919(18)3523(20)3024(29)262725(30)3416(2)21(31)28101233131128h571416H34813H212H3
MFCD03007662
ZINC000001239233
ZINC000001239234
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