Vitas-M small molecule compound
(2E)-2-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-5-(4-methoxyphenyl)-7-methyl-N-(2-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Catalog ID
STL397577
SMILES COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C\c1cn(nc1C)CC)/s2)C(=O)Nc1ccccc1C
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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 C29H29N5O3S MW 527.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N5O3S/c1-6-33-16-21(18(3)32-33)15-24-28(36)34-26(20-11-13-22(37-5)14-12-20)25(19(4)30-29(34)38-24)27(35)31-23-10-8-7-9-17(23)2/h7-16,26H,6H2,1-5H3,(H,31,35)/b24-15+InChIKey
PGAARGUUXBVQLH-BUVRLJJBSA-NSynonyms
512814-64-1(2E)2((1ETHYL3METHYL1HPYRAZOL4YL)METHYLIDENE)5(4METHOXYPHENYL)7METHYLN(2METHYLPHENYL)3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
(2E)2((1ETHYL3METHYLPYRAZOL4YL)METHYLIDENE)5(4METHOXYPHENYL)7METHYLN(2METHYLPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
2((1ETHYL3METHYL1HPYRAZOL4YL)METHYLENE)5(4METHOXYPHENYL)7METHYLN(2METHYLPHENYL)3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
512814641
CCN1C=C(C(=N1)C)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)NC4=CC=CC=C4C)C5=CC=C(C=C5)OC
COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=Cc1cn(nc1C)CC)s2)C(=O)Nc1ccccc1C
InChI=1SC29H29N5O3Sc16331621(18(3)3233)152428(36)3426(20111322(375)141220)25(19(4)3029(34)3824)27(35)31231087917(23)2h71626H6H215H3(H3135)b2415+
MFCD03466941
ZINC000000651424
ZINC000002760589
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