Vitas-M small molecule compound

{[6,6-dimethyl-4-oxo-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetic acid

Catalog ID
STL303859
SMILES C=CCn1c(SCC(=O)O)nc2c(c1=O)c1CC(C)(C)OCc1s2

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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 C16H18N2O4S2 MW 366.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O4S2/c1-4-5-18-14(21)12-9-6-16(2,3)22-7-10(9)24-13(12)17-15(18)23-8-11(19)20/h4H,1,5-8H2,2-3H3,(H,19,20)
InChIKey
SNSLCCKLTIUTBA-UHFFFAOYSA-N
Synonyms
316360-88-0
((66dimethyl4oxo3(prop2en1yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)aceticacid
2((3allyl66dimethyl4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)aceticacid
2((66dimethyl4oxo3prop2enyl58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)aceticacid
316360880
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)O)CC=C)C
InChI=1SC16H18N2O4S2c1451814(21)129616(23)22710(9)2413(12)1715(18)23811(19)20h4H158H223H3(H1920)
MFCD00698466
ZINC000000820776
ZINC820776

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Available files

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