Vitas-M small molecule compound
2-[(furan-2-ylmethyl)amino]-7-methyl-3-{(E)-[4-oxo-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK815299
SMILES Cc1ccc2n(c1)c(=O)c(c(n2)NCc1ccco1)/C=C\1/SC(=S)N(C1=O)C(c1ccccc1)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 C26H22N4O3S2 MW 502.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O3S2/c1-16-10-11-22-28-23(27-14-19-9-6-12-33-19)20(24(31)29(22)15-16)13-21-25(32)30(26(34)35-21)17(2)18-7-4-3-5-8-18/h3-13,15,17,27H,14H2,1-2H3/b21-13+InChIKey
WSRZCSISCDPSGR-FYJGNVAPSA-NSynonyms
(5E)5((2(furan2ylmethylamino)7methyl4oxopyrido(12a)pyrimidin3yl)methylidene)3(1phenylethyl)2sulfanylidene13thiazolidin4one
2((furan2ylmethyl)amino)7methyl3((E)(4oxo3(1phenylethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C(C)C4=CC=CC=C4)NCC5=CC=CO5)C=C1
Cc1ccc2n(c1)c(=O)c(c(n2)NCc1ccco1)C=C1SC(=S)N(C1=O)C(c1ccccc1)C
InChI=1SC26H22N4O3S2c1161011222823(27141996123319)20(24(31)29(22)1516)132125(32)30(26(34)3521)17(2)187435818h313151727H14H212H3b2113+
MFCD04442613
ZINC000001103785
ZINC000001103787
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