Vitas-M small molecule compound
1-(hexylsulfanyl)-4-(3-methylphenyl)-7-(propan-2-yl)-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
STL332723
SMILES CCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)C(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 C26H32N4O2S2 MW 496.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4O2S2/c1-5-6-7-8-12-33-26-28-27-25-29(18-11-9-10-17(4)13-18)23(31)22-19-14-20(16(2)3)32-15-21(19)34-24(22)30(25)26/h9-11,13,16,20H,5-8,12,14-15H2,1-4H3InChIKey
AMNIGQPPKNJTMS-UHFFFAOYSA-NSynonyms
371203-90-61(hexylsulfanyl)4(3methylphenyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(hexylthio)7isopropyl4(mtolyl)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
371203906
CCCCCCSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)C(C)C)C(=O)N2C5=CC=CC(=C5)C
InChI=1SC26H32N4O2S2c1567812332628272529(181191017(4)1318)23(31)22191420(16(2)3)321521(19)3424(22)30(25)26h911131620H58121415H214H3
MFCD03009489
ZINC000002315384
ZINC000002315385
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