Vitas-M small molecule compound
4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)-2-methoxyphenyl naphthalene-1-carboxylate
Catalog ID
STK746069
SMILES COc1cc(ccc1OC(=O)c1cccc2c1cccc2)C1N=C(O)c2c(N1)sc1c2CCN(C1)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 C28H25N3O4S MW 499.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O4S/c1-31-13-12-20-23(15-31)36-27-24(20)26(32)29-25(30-27)17-10-11-21(22(14-17)34-2)35-28(33)19-9-5-7-16-6-3-4-8-18(16)19/h3-11,14,25,30H,12-13,15H2,1-2H3,(H,29,32)InChIKey
VIQISXNXRTZIHO-UHFFFAOYSA-NSynonyms
498537-26-1(2methoxy4(7methyl4oxo123568hexahydropyrido(23)thieno(24d)pyrimidin2yl)phenyl)naphthalene1carboxylate
4(4hydroxy7methyl125678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)2methoxyphenylnaphthalene1carboxylate
498537261
CN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=C(C=C4)OC(=O)C5=CC=CC6=CC=CC=C65)OC
InChI=1SC28H25N3O4Sc13113122023(1531)362724(20)26(32)2925(3027)17101121(22(1417)342)3528(33)1995716634818(16)19h311142530H121315H212H3(H2932)
MFCD03806272
ZINC000009045784
ZINC000009045790
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