Vitas-M small molecule compound
ethyl 4-[(7Z)-6-oxo-7-(pyridin-4-ylmethylidene)-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl]benzoate
Catalog ID
STK859781
SMILES CCOC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)/c(=C/c1ccncc1)/s2
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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 C20H18N4O3S MW 394.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O3S/c1-2-27-19(26)15-3-5-16(6-4-15)23-12-22-20-24(13-23)18(25)17(28-20)11-14-7-9-21-10-8-14/h3-11H,2,12-13H2,1H3/b17-11-InChIKey
RZYJHGXBJIHESO-BOPFTXTBSA-NSynonyms
(Z)ethyl4(6oxo7(pyridin4ylmethylene)67dihydro2Hthiazolo(32a)(135)triazin3(4H)yl)benzoate
CCOC(=O)C1=CC=C(C=C1)N2CN=C3N(C2)C(=O)C(=CC4=CC=NC=C4)S3
CCOC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)c(=Cc1ccncc1)s2
ETHYL4((7Z)6OXO7(PYRIDIN4YLMETHYLIDENE)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN3YL)BENZOATE
ethyl4((7Z)6oxo7(pyridin4ylmethylidene)67dihydro2H(13)thiazolo(32a)(135)triazin3(4H)yl)benzoate
InChI=1SC20H18N4O3Sc122719(26)153516(6415)2312222024(1323)18(25)17(2820)1114792110814h311H21213H21H3b1711
MFCD02985115
ZINC000001182910
ZINC01182910
ZINC1182910
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