Vitas-M small molecule compound
methyl (2Z)-5-amino-6-cyano-3-oxo-7-(pyridin-4-yl)-2-(pyridin-4-ylmethylidene)-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Catalog ID
STK790891
SMILES N#CC1=C(N)n2c(=C(C1c1ccncc1)C(=O)OC)s/c(=C\c1ccncc1)/c2=O
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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 C21H15N5O3S MW 417.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N5O3S/c1-29-21(28)17-16(13-4-8-25-9-5-13)14(11-22)18(23)26-19(27)15(30-20(17)26)10-12-2-6-24-7-3-12/h2-10,16H,23H2,1H3/b15-10-InChIKey
GBOCTUSUMGBHSQ-GDNBJRDFSA-NSynonyms
(E)methyl5amino6cyano3oxo7(pyridin4yl)2(pyridin4ylmethylene)37dihydro2Hthiazolo(32a)pyridine8carboxylate
COC(=O)C1=C2N(C(=C(C1C3=CC=NC=C3)C#N)N)C(=O)C(=CC4=CC=NC=C4)S2
InChI=1SC21H15N5O3Sc12921(28)1716(1348259513)14(1122)18(23)2619(27)15(3020(17)26)101226247312h21016H23H21H3b1510
methyl(2Z)5amino6cyano3oxo7(pyridin4yl)2(pyridin4ylmethylidene)23dihydro7H(13)thiazolo(32a)pyridine8carboxylate
METHYL(2Z)5AMINO6CYANO3OXO7PYRIDIN4YL2(PYRIDIN4YLMETHYLIDENE)7H(13)THIAZOLO(32A)PYRIDINE8CARBOXYLATE
MFCD02061641
N#CC1=C(N)n2c(=C(C1c1ccncc1)C(=O)OC)sc(=Cc1ccncc1)c2=O
ZINC000036125712
ZINC000036125714
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