Vitas-M small molecule compound
4-(3-chlorophenyl)-1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-7,7-dimethyl-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
STK557441
SMILES Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)Cl)CC(OC3)(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 C26H20Cl2N4O3S2 MW 571.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20Cl2N4O3S2/c1-26(2)11-18-20(12-35-26)37-23-21(18)22(34)31(17-5-3-4-16(28)10-17)24-29-30-25(32(23)24)36-13-19(33)14-6-8-15(27)9-7-14/h3-10H,11-13H2,1-2H3InChIKey
MHDMYCOIQDLUKN-UHFFFAOYSA-NSynonyms
4(3chlorophenyl)1((2(4chlorophenyl)2oxoethyl)sulfanyl)77dimethyl69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4(3chlorophenyl)1((2(4chlorophenyl)2oxoethyl)thio)77dimethyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)C5=CC=C(C=C5)Cl)C6=CC(=CC=C6)Cl)C
InChI=1SC26H20Cl2N4O3S2c126(2)111820(123526)372321(18)22(34)31(1753416(28)1017)24293025(32(23)24)361319(33)146815(27)9714h310H1113H212H3
MFCD04025420
ZINC000001875382
ZINC01875382
ZINC1875382
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