Vitas-M small molecule compound
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
STK384613
SMILES CCN1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(cc1)OC(=O)c1cccc2c1cccc2)O
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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 C28H25N3O3S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O3S/c1-2-31-15-14-22-23(16-31)35-27-24(22)26(32)29-25(30-27)18-10-12-19(13-11-18)34-28(33)21-9-5-7-17-6-3-4-8-20(17)21/h3-13,25,30H,2,14-16H2,1H3,(H,29,32)InChIKey
NYJZQKYGHPEYFE-UHFFFAOYSA-NSynonyms
(4(7ethyl4oxo123568hexahydropyrido(23)thieno(24d)pyrimidin2yl)phenyl)naphthalene1carboxylate
4(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
InChI=1SC28H25N3O3Sc123115142223(1631)352724(22)26(32)2925(3027)18101219(131118)3428(33)2195717634820(17)21h3132530H21416H21H3(H2932)
MFCD04966724
ZINC000015947148
ZINC000015947150
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