Vitas-M small molecule compound
2-ethoxy-4-(7-ethyl-4-hydroxy-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)phenyl naphthalene-1-carboxylate
Catalog ID
STK384721
SMILES CCOc1cc(ccc1OC(=O)c1cccc2c1cccc2)C1N=C(O)c2c(N1)sc1c2CCN(C1)CC
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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 C30H29N3O4S MW 527.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O4S/c1-3-33-15-14-22-25(17-33)38-29-26(22)28(34)31-27(32-29)19-12-13-23(24(16-19)36-4-2)37-30(35)21-11-7-9-18-8-5-6-10-20(18)21/h5-13,16,27,32H,3-4,14-15,17H2,1-2H3,(H,31,34)InChIKey
ZQOLKVJBARGKNO-UHFFFAOYSA-NSynonyms
(2ethoxy4(7ethyl4oxo123568hexahydropyrido(23)thieno(24d)pyrimidin2yl)phenyl)naphthalene1carboxylate
2ethoxy4(7ethyl4hydroxy125678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)phenylnaphthalene1carboxylate
CCN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=C(C=C4)OC(=O)C5=CC=CC6=CC=CC=C65)OCC
InChI=1SC30H29N3O4Sc133315142225(1733)382926(22)28(34)3127(3229)19121323(24(1619)3642)3730(35)211179188561020(18)21h513162732H34141517H212H3(H3134)
MFCD05661653
ZINC000015947261
ZINC000015947263
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