Vitas-M small molecule compound

methyl N-{[1-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]carbonyl}-L-valinate

Catalog ID
STK928482
SMILES COC(=O)[C@H](C(C)C)NC(=O)C1CCN(CC1)c1ncnc2c1c1CCCCc1s2

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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 C22H30N4O3S MW 430.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O3S/c1-13(2)18(22(28)29-3)25-20(27)14-8-10-26(11-9-14)19-17-15-6-4-5-7-16(15)30-21(17)24-12-23-19/h12-14,18H,4-11H2,1-3H3,(H,25,27)/t18-/m0/s1
InChIKey
SUBGRJLICBCDBG-SFHVURJKSA-N
Synonyms
1291780-59-0
(S)methyl3methyl2(1(5678tetrahydrobenzo(45)thieno(23d)pyrimidin4yl)piperidine4carboxamido)butanoate
1291780590
CC(C)C(C(=O)OC)NC(=O)C1CCN(CC1)C2=C3C4=C(CCCC4)SC3=NC=N2
COC(=O)(C@H)(C(C)C)NC(=O)C1CCN(CC1)c1ncnc2c1c1CCCCc1s2
InChI=1SC22H30N4O3Sc113(2)18(22(28)293)2520(27)1481026(11914)191715645716(15)3021(17)24122319h121418H411H213H3(H2527)t18m0s1
methyl(2S)3methyl2((1(5678tetrahydro(1)benzothiolo(23d)pyrimidin4yl)piperidine4carbonyl)amino)butanoate
methylN((1(5678tetrahydro(1)benzothieno(23d)pyrimidin4yl)piperidin4yl)carbonyl)Lvalinate
MFCD18176107
ZINC000040266171
ZINC40266171

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Available files

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