Vitas-M small molecule compound
4-(3-methylphenyl)-7-(propan-2-yl)-1-(propylsulfanyl)-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
STL234609
SMILES CCCSc1nnc2n1c1sc3c(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 C23H26N4O2S2 MW 454.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O2S2/c1-5-9-30-23-25-24-22-26(15-8-6-7-14(4)10-15)20(28)19-16-11-17(13(2)3)29-12-18(16)31-21(19)27(22)23/h6-8,10,13,17H,5,9,11-12H2,1-4H3InChIKey
CHRSFXYDSNCNEW-UHFFFAOYSA-NSynonyms
371127-07-0371127070
4(3methylphenyl)7(propan2yl)1(propylsulfanyl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
7isopropyl1(propylthio)4(mtolyl)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CCCSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)C(C)C)C(=O)N2C5=CC=CC(=C5)C
InChI=1SC23H26N4O2S2c159302325242226(1586714(4)1015)20(28)19161117(13(2)3)291218(16)3121(19)27(22)23h68101317H591112H214H3
MFCD03008069
ZINC000001829026
ZINC000001829027
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