Vitas-M small molecule compound
4-benzyl-1-[(3,4-dichlorobenzyl)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
STK530068
SMILES Clc1ccc(cc1Cl)CSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)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 C26H22Cl2N4O2S2 MW 557.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22Cl2N4O2S2/c1-26(2)11-17-20(13-34-26)36-23-21(17)22(33)31(12-15-6-4-3-5-7-15)24-29-30-25(32(23)24)35-14-16-8-9-18(27)19(28)10-16/h3-10H,11-14H2,1-2H3InChIKey
WZXSSFIDHGTBOR-UHFFFAOYSA-NSynonyms
4benzyl1((34dichlorobenzyl)sulfanyl)77dimethyl69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4benzyl1((34dichlorobenzyl)thio)77dimethyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC(=C(C=C5)Cl)Cl)CC6=CC=CC=C6)C
InChI=1SC26H22Cl2N4O2S2c126(2)111720(133426)362321(17)22(33)31(12156435715)24293025(32(23)24)3514168918(27)19(28)1016h310H1114H212H3
MFCD01558873
ZINC000001871421
ZINC01871421
ZINC1871421
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