Vitas-M small molecule compound
4-(3-methylphenyl)-1-(pentylsulfanyl)-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
STL235661
SMILES CCCCCSc1nnc2n1c1sc3c(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 C25H30N4O2S2 MW 482.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O2S2/c1-5-6-7-11-32-25-27-26-24-28(17-10-8-9-16(4)12-17)22(30)21-18-13-19(15(2)3)31-14-20(18)33-23(21)29(24)25/h8-10,12,15,19H,5-7,11,13-14H2,1-4H3InChIKey
BJCOECNWGMWMAM-UHFFFAOYSA-NSynonyms
371136-49-1371136491
4(3methylphenyl)1(pentylsulfanyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
7isopropyl1(pentylthio)4(mtolyl)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CCCCCSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)C(C)C)C(=O)N2C5=CC=CC(=C5)C
InChI=1SC25H30N4O2S2c156711322527262428(17108916(4)1217)22(30)21181319(15(2)3)311420(18)3323(21)29(24)25h810121519H57111314H214H3
MFCD03008735
ZINC000002314547
ZINC000002314548
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