Vitas-M small molecule compound
2-{[3-(1H-imidazol-1-yl)propyl]amino}-9-methyl-3-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK876763
SMILES S=C1S/C(=C\c2c(NCCCn3cncc3)nc3n(c2=O)cccc3C)/C(=O)N1C
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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 C20H20N6O2S2 MW 440.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N6O2S2/c1-13-5-3-9-26-17(13)23-16(22-6-4-8-25-10-7-21-12-25)14(18(26)27)11-15-19(28)24(2)20(29)30-15/h3,5,7,9-12,22H,4,6,8H2,1-2H3/b15-11-InChIKey
XHKMCFMSYGVFFR-PTNGSMBKSA-NSynonyms
(5Z)5((2(3IMIDAZOL1YLPROPYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3METHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((3(1Himidazol1yl)propyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3methyl2thioxothiazolidin4one
2((3(1Himidazol1yl)propyl)amino)9methyl3((Z)(3methyl4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C)NCCCN4C=CN=C4
InChI=1SC20H20N6O2S2c1135392617(13)2316(2264825107211225)14(18(26)27)111519(28)24(2)20(29)3015h35791222H468H212H3b1511
MFCD01959800
S=C1SC(=Cc2c(NCCCn3cncc3)nc3n(c2=O)cccc3C)C(=O)N1C
ZINC000009310547
ZINC9310547
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