Vitas-M small molecule compound
2-[(2-hydroxypropyl)sulfanyl]-3-(4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK722264
SMILES COc1ccc(cc1)n1c(SCC(O)C)nc2c(c1=O)c1CCC(Cc1s2)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 C21H24N2O3S2 MW 416.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O3S2/c1-12-4-9-16-17(10-12)28-19-18(16)20(25)23(21(22-19)27-11-13(2)24)14-5-7-15(26-3)8-6-14/h5-8,12-13,24H,4,9-11H2,1-3H3InChIKey
IZWBBLRVIZZLRJ-UHFFFAOYSA-NSynonyms
2((2hydroxypropyl)sulfanyl)3(4methoxyphenyl)7methyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((2hydroxypropyl)thio)3(4methoxyphenyl)7methyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2(2hydroxypropylsulfanyl)3(4methoxyphenyl)7methyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(C)O)C4=CC=C(C=C4)OC
InChI=1SC21H24N2O3S2c112491617(1012)281918(16)20(25)23(21(2219)271113(2)24)145715(263)8614h58121324H4911H213H3
MFCD02234503
ZINC000000986167
ZINC000000986170
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