Vitas-M small molecule compound
ethyl [(7-benzyl-3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Catalog ID
STK031748
SMILES CCOC(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCN(C3)Cc1ccccc1
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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 C26H31N3O3S2 MW 497.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O3S2/c1-2-32-22(30)17-33-26-27-24-23(25(31)29(26)19-11-7-4-8-12-19)20-13-14-28(16-21(20)34-24)15-18-9-5-3-6-10-18/h3,5-6,9-10,19H,2,4,7-8,11-17H2,1H3InChIKey
ODZJEPAXGWKIGJ-UHFFFAOYSA-NSynonyms
351341-87-2351341872
CCOC(=O)CSC1=NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C(=O)N1C5CCCCC5
CCOC(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCN(C3)Cc1ccccc1
ethyl((7benzyl3cyclohexyl4oxo345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetate
ethyl2((7benzyl3cyclohexyl4oxo345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)thio)acetate
ethyl2((7benzyl3cyclohexyl4oxo68dihydro5Hpyrido(23)thieno(24b)pyrimidin2yl)sulfanyl)acetate
InChI=1SC26H31N3O3S2c123222(30)173326272423(25(31)29(26)19117481219)20131428(1621(20)3424)151895361018h35691019H24781117H21H3
MFCD01557133
STK031748
ZINC000013940892
ZINC13940892
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