Vitas-M small molecule compound
(2E)-2-(1,3-benzothiazol-2-yl)-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}prop-2-enenitrile
Catalog ID
STK800221
SMILES COc1ccc(cc1)N1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C(/c1nc2c(s1)cccc2)\C#N
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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 C29H24N6O2S MW 520.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N6O2S/c1-37-22-11-9-21(10-12-22)33-14-16-34(17-15-33)27-23(29(36)35-13-5-4-8-26(35)32-27)18-20(19-30)28-31-24-6-2-3-7-25(24)38-28/h2-13,18H,14-17H2,1H3/b20-18+InChIKey
UTBVHQCDLIVZNQ-CZIZESTLSA-NSynonyms
877809-19-3(2E)2(13benzothiazol2yl)3(2(4(4methoxyphenyl)piperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)prop2enenitrile
(E)2(13BENZOTHIAZOL2YL)3(2(4(4METHOXYPHENYL)PIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENENITRILE
(E)2(benzo(d)thiazol2yl)3(2(4(4methoxyphenyl)piperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)acrylonitrile
877809193
COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=O)N4C=CC=CC4=N3)C=C(C#N)C5=NC6=CC=CC=C6S5
COc1ccc(cc1)N1CCN(CC1)c1nc2ccccn2c(=O)c1C=C(c1nc2c(s1)cccc2)C#N
InChI=1SC29H24N6O2Sc1372211921(101222)33141634(171533)2723(29(36)351354826(35)3227)1820(1930)283124623725(24)3828h21318H1417H21H3b2018+
MFCD03670704
ZINC000009293675
ZINC9293675
Check stock
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Check stock on Vitas-MAvailable files
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