Vitas-M small molecule compound
2-{[3-(1H-imidazol-1-yl)propyl]amino}-9-methyl-3-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK794303
SMILES S=C1S/C(=C\c2c(NCCCn3cncc3)nc3n(c2=O)cccc3C)/C(=O)N1CCc1ccccc1
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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 C27H26N6O2S2 MW 530.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N6O2S2/c1-19-7-5-14-32-24(19)30-23(29-11-6-13-31-16-12-28-18-31)21(25(32)34)17-22-26(35)33(27(36)37-22)15-10-20-8-3-2-4-9-20/h2-5,7-9,12,14,16-18,29H,6,10-11,13,15H2,1H3/b22-17-InChIKey
NWGCZXLMKMYPSV-XLNRJJMWSA-NSynonyms
(5Z)5((2(3imidazol1ylpropylamino)9methyl4oxopyrido(12a)pyrimidin3yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
(5Z)5((2(3IMIDAZOL1YLPROPYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((3(1Himidazol1yl)propyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3phenethyl2thioxothiazolidin4one
2((3(1Himidazol1yl)propyl)amino)9methyl3((Z)(4oxo3(2phenylethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)NCCCN5C=CN=C5
InChI=1SC27H26N6O2S2c11975143224(19)3023(2911613311612281831)21(25(32)34)172226(35)33(27(36)3722)1510208324920h25791214161829H610111315H21H3b2217
MFCD01959960
S=C1SC(=Cc2c(NCCCn3cncc3)nc3n(c2=O)cccc3C)C(=O)N1CCc1ccccc1
ZINC000005401698
ZINC5401698
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