Vitas-M small molecule compound
2-[(4-oxo-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoic acid
Catalog ID
STL324076
SMILES CC(C(=O)O)Sc1nc2sc3c(c2c(=O)n1c1ccccc1)CCC3
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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 C18H16N2O3S2 MW 372.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O3S2/c1-10(17(22)23)24-18-19-15-14(12-8-5-9-13(12)25-15)16(21)20(18)11-6-3-2-4-7-11/h2-4,6-7,10H,5,8-9H2,1H3,(H,22,23)InChIKey
DCXGFVOUQZLNMA-UHFFFAOYSA-NSynonyms
327168-60-52((1oxo2phenyl78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin3yl)sulfanyl)propanoicacid
2((4oxo3phenyl3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin2yl)sulfanyl)propanoicacid
2((4oxo3phenyl4567tetrahydro3Hcyclopenta(45)thieno(23d)pyrimidin2yl)thio)propanoicacid
327168605
CC(C(=O)O)SC1=NC2=C(C3=C(S2)CCC3)C(=O)N1C4=CC=CC=C4
InChI=1SC18H16N2O3S2c110(17(22)23)2418191514(1285913(12)2515)16(21)20(18)116324711h246710H589H21H3(H2223)
MFCD01087248
ZINC000002197166
ZINC000002197168
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