Vitas-M small molecule compound
(2Z)-2-{[2-(4-tert-butylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK799569
SMILES O=c1c(/C=c/2\sc3n(c2=O)c2c(n3)cccc2)c(Oc2ccc(cc2)C(C)(C)C)nc2n1cccc2
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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 C28H22N4O3S MW 494.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O3S/c1-28(2,3)17-11-13-18(14-12-17)35-24-19(25(33)31-15-7-6-10-23(31)30-24)16-22-26(34)32-21-9-5-4-8-20(21)29-27(32)36-22/h4-16H,1-3H3/b22-16-InChIKey
KEJDNMHNFJUVLI-JWGURIENSA-NSynonyms
(2Z)2((2(4tertbutylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(2Z)2((2(4tertbutylphenoxy)4oxopyrido(12a)pyrimidin3yl)methylidene)(13)thiazolo(32a)benzimidazol1one
CC(C)(C)C1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N5C6=CC=CC=C6N=C5S4
InChI=1SC28H22N4O3Sc128(23)17111318(141217)352419(25(33)3115761023(31)3024)162226(34)3221954820(21)2927(32)3622h416H13H3b2216
MFCD06642802
O=c1c(C=c2sc3n(c2=O)c2c(n3)cccc2)c(Oc2ccc(cc2)C(C)(C)C)nc2n1cccc2
ZINC000016735053
ZINC16735053
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