Vitas-M small molecule compound

3-[(Z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[(2-hydroxy-2-phenylethyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK707091
SMILES S=C1S/C(=C\c2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)/C(=O)N1C1CCCCC1

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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 C26H26N4O3S2 MW 506.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O3S2/c31-20(17-9-3-1-4-10-17)16-27-23-19(24(32)29-14-8-7-13-22(29)28-23)15-21-25(33)30(26(34)35-21)18-11-5-2-6-12-18/h1,3-4,7-10,13-15,18,20,27,31H,2,5-6,11-12,16H2/b21-15-
InChIKey
JXYRERDXHLJMHX-QNGOZBTKSA-N
Synonyms
843629-09-4
(5Z)3CYCLOHEXYL5((2((2HYDROXY2PHENYLETHYL)AMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3cyclohexyl5((2((2hydroxy2phenylethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3cyclohexyl4oxo2thioxo13thiazolidin5ylidene)methyl)2((2hydroxy2phenylethyl)amino)4Hpyrido(12a)pyrimidin4one
843629094
C1CCC(CC1)N2C(=O)C(=CC3=C(N=C4C=CC=CN4C3=O)NCC(C5=CC=CC=C5)O)SC2=S
InChI=1SC26H26N4O3S2c3120(1793141017)16272319(24(32)2914871322(29)2823)152125(33)30(26(34)3521)18115261218h134710131518202731H256111216H2b2115
MFCD04015784
S=C1SC(=Cc2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)C(=O)N1C1CCCCC1
ZINC000002438799
ZINC000002438803

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Available files

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