Vitas-M small molecule compound

ethyl 7,8-dicyano-2-methyl-4-(4-methylphenyl)-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylate

Catalog ID
STL434861
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c1cc(C#N)c(cc1s2)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 C23H18N4O2S MW 414.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O2S/c1-4-29-22(28)20-14(3)26-23-27(21(20)15-7-5-13(2)6-8-15)18-9-16(11-24)17(12-25)10-19(18)30-23/h5-10,21H,4H2,1-3H3
InChIKey
RDOVRRITSGJLGB-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C)C4=C(S2)C=C(C(=C4)C#N)C#N)C
ethyl78dicyano2methyl4(4methylphenyl)4Hpyrimido(21b)(13)benzothiazole3carboxylate
InChI=1SC23H18N4O2Sc142922(28)2014(3)262327(21(20)157513(2)6815)18916(1124)17(1225)1019(18)3023h51021H4H213H3
MFCD30711475
ZINC000253471409
ZINC000253471410

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Available files

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