Vitas-M small molecule compound
methyl (2Z)-5-amino-6-cyano-3-oxo-7-(pyridin-3-yl)-2-(pyridin-3-ylmethylidene)-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Catalog ID
STK790972
SMILES N#CC1=C(N)n2c(=C(C1c1cccnc1)C(=O)OC)s/c(=C\c1cccnc1)/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(13-5-3-7-25-11-13)14(9-22)18(23)26-19(27)15(30-20(17)26)8-12-4-2-6-24-10-12/h2-8,10-11,16H,23H2,1H3/b15-8-InChIKey
ICXCKNSIYUVEDG-NVNXTCNLSA-NSynonyms
COC(=O)C1=C2N(C(=C(C1C3=CN=CC=C3)C#N)N)C(=O)C(=CC4=CN=CC=C4)S2
InChI=1SC21H15N5O3Sc12921(28)1716(13537251113)14(922)18(23)2619(27)15(3020(17)26)812426241012h28101116H23H21H3b158
methyl(2Z)5amino6cyano3oxo7(pyridin3yl)2(pyridin3ylmethylidene)23dihydro7H(13)thiazolo(32a)pyridine8carboxylate
METHYL(2Z)5AMINO6CYANO3OXO7PYRIDIN3YL2(PYRIDIN3YLMETHYLIDENE)7H(13)THIAZOLO(32A)PYRIDINE8CARBOXYLATE
methyl5amino6cyano3oxo7(pyridin3yl)2(pyridin3ylmethylene)37dihydro2Hthiazolo(32a)pyridine8carboxylate
MFCD01877763
N#CC1=C(N)n2c(=C(C1c1cccnc1)C(=O)OC)sc(=Cc1cccnc1)c2=O
ZINC000006878977
ZINC000006878978
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