Vitas-M small molecule compound
3-benzyl-6,6-dimethyl-2-thioxo-1,2,3,5,6,8-hexahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK053767
SMILES S=c1[nH]c2sc3c(c2c(=O)n1Cc1ccccc1)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 C18H18N2O2S2 MW 358.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O2S2/c1-18(2)8-12-13(10-22-18)24-15-14(12)16(21)20(17(23)19-15)9-11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3,(H,19,23)InChIKey
YXVJROUYSNWFDB-UHFFFAOYSA-NSynonyms
332145-23-03benzyl66dimethyl2sulfanylidene58dihydro1Hpyrano(23)thieno(24b)pyrimidin4one
3benzyl66dimethyl2thioxo123568hexahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
3benzyl66dimethyl2thioxo2356tetrahydro1Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=S)N3)CC4=CC=CC=C4)C
InChI=1SC18H18N2O2S2c118(2)81213(102218)241514(12)16(21)20(17(23)1915)9116435711h37H810H212H3(H1923)
S=c1(nH)c2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)(C)C
STK053767
ZINC000018107394
ZINC18107394
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