Vitas-M small molecule compound
2-{[3-(1H-imidazol-1-yl)propyl]amino}-9-methyl-3-{(E)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK813735
SMILES CC(CN1C(=S)S/C(=C/c2c(NCCCn3cncc3)nc3n(c2=O)cccc3C)/C1=O)C
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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 C23H26N6O2S2 MW 482.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N6O2S2/c1-15(2)13-29-22(31)18(33-23(29)32)12-17-19(25-7-5-9-27-11-8-24-14-27)26-20-16(3)6-4-10-28(20)21(17)30/h4,6,8,10-12,14-15,25H,5,7,9,13H2,1-3H3/b18-12+InChIKey
LRFVFUFOTZNCFP-LDADJPATSA-NSynonyms
(5E)5((2(3imidazol1ylpropylamino)9methyl4oxopyrido(12a)pyrimidin3yl)methylidene)3(2methylpropyl)2sulfanylidene13thiazolidin4one
(Z)5((2((3(1Himidazol1yl)propyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3isobutyl2thioxothiazolidin4one
2((3(1Himidazol1yl)propyl)amino)9methyl3((E)(3(2methylpropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC(CN1C(=S)SC(=Cc2c(NCCCn3cncc3)nc3n(c2=O)cccc3C)C1=O)C
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC(C)C)NCCCN4C=CN=C4
InChI=1SC23H26N6O2S2c115(2)132922(31)18(3323(29)32)121719(2575927118241427)262016(3)641028(20)21(17)30h4681012141525H57913H213H3b1812+
MFCD04441744
ZINC000033442509
ZINC33442509
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