Vitas-M small molecule compound
ethyl (2Z)-7-methyl-2-(4-methylbenzylidene)-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK000592
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1ccc(cc1)C)/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 C27H28N2O3S MW 460.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O3S/c1-6-32-26(31)23-18(5)28-27-29(24(23)21-13-11-20(12-14-21)16(2)3)25(30)22(33-27)15-19-9-7-17(4)8-10-19/h7-16,24H,6H2,1-5H3/b22-15-InChIKey
KJYITSPNACLWKI-JCMHNJIXSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)c(=Cc1ccc(cc1)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)C)C(=O)C(=CC4=CC=C(C=C4)C)S2)C
ETHYL(2Z)7METHYL2((4METHYLPHENYL)METHYLIDENE)3OXO5(4PROPAN2YLPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)7METHYL2(4METHYLBENZYLIDENE)3OXO5(4(PROPAN2YL)PHENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC27H28N2O3Sc163226(31)2318(5)282729(24(23)21131120(121421)16(2)3)25(30)22(3327)15199717(4)81019h71624H6H215H3b2215
MFCD02313042
STK000592
ZINC000008915926
ZINC000012285059
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