Vitas-M small molecule compound
1-(butylsulfanyl)-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
STK699024
SMILES CCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)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 C23H26N4O2S2 MW 454.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O2S2/c1-5-6-11-30-22-25-24-21-26(15-9-7-14(2)8-10-15)19(28)18-16-12-23(3,4)29-13-17(16)31-20(18)27(21)22/h7-10H,5-6,11-13H2,1-4H3InChIKey
KOVSWFLJRNKUMU-UHFFFAOYSA-NSynonyms
306294-20-21(butylsulfanyl)77dimethyl4(4methylphenyl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(butylthio)77dimethyl4(ptolyl)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
306294202
CCCCSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)(C)C)C(=O)N2C5=CC=C(C=C5)C
InChI=1SC23H26N4O2S2c15611302225242126(159714(2)81015)19(28)18161223(34)291317(16)3120(18)27(21)22h710H561113H214H3
MFCD01880798
ZINC000002276077
ZINC02276077
ZINC2276077
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