Vitas-M small molecule compound
1-[(3,4-dichlorobenzyl)sulfanyl]-7,7-dimethyl-4-(4-methylphenyl)-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
STK699036
SMILES Cc1ccc(cc1)n1c(=O)c2c3CC(C)(C)OCc3sc2n2c1nnc2SCc1ccc(c(c1)Cl)Cl
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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/c1-14-4-7-16(8-5-14)31-22(33)21-17-11-26(2,3)34-12-20(17)36-23(21)32-24(31)29-30-25(32)35-13-15-6-9-18(27)19(28)10-15/h4-10H,11-13H2,1-3H3InChIKey
HJCZTBVBOZHCPG-UHFFFAOYSA-NSynonyms
1((34dichlorobenzyl)sulfanyl)77dimethyl4(4methylphenyl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((34dichlorobenzyl)thio)77dimethyl4(ptolyl)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CC1=CC=C(C=C1)N2C(=O)C3=C(N4C2=NN=C4SCC5=CC(=C(C=C5)Cl)Cl)SC6=C3CC(OC6)(C)C
InChI=1SC26H22Cl2N4O2S2c1144716(8514)3122(33)21171126(23)341220(17)3623(21)3224(31)293025(32)3513156918(27)19(28)1015h410H1113H213H3
MFCD01879050
ZINC000001885238
ZINC01885238
ZINC1885238
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