Vitas-M small molecule compound

ethyl (2Z)-2-benzylidene-3-oxo-5,7-diphenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK362055
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccccc1)c(=O)/c(=C/c1ccccc1)/s2)c1ccccc1

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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 C28H22N2O3S MW 466.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N2O3S/c1-2-33-27(32)23-24(20-14-8-4-9-15-20)29-28-30(25(23)21-16-10-5-11-17-21)26(31)22(34-28)18-19-12-6-3-7-13-19/h3-18,25H,2H2,1H3/b22-18-
InChIKey
DVFDZGNNIGZQTM-PYCFMQQDSA-N
Synonyms

(E)ethyl2benzylidene3oxo57diphenyl35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccccc1)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC=CC=C4)S2)C5=CC=CC=C5
ETHYL(2Z)2BENZYLIDENE3OXO57DIPHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2BENZYLIDENE3OXO57DIPHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL3OXO57DIPHENYL2(PHENYLMETHYLENE)45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H22N2O3Sc123327(32)2324(20148491520)292830(25(23)2116105111721)26(31)22(3428)1819126371319h31825H2H21H3b2218
MFCD01874582
ZINC000002355532
ZINC000002355535

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.