Vitas-M small molecule compound
3-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(4-benzylpiperazin-1-yl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK793994
SMILES Cc1ccc2n(c1)c(=O)c(c(n2)N1CCN(CC1)Cc1ccccc1)/C=C/1\SC(=S)N(C1=O)Cc1ccccc1
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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 C31H29N5O2S2 MW 567.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N5O2S2/c1-22-12-13-27-32-28(34-16-14-33(15-17-34)20-23-8-4-2-5-9-23)25(29(37)35(27)19-22)18-26-30(38)36(31(39)40-26)21-24-10-6-3-7-11-24/h2-13,18-19H,14-17,20-21H2,1H3/b26-18-InChIKey
PRFSHCGPZHDTKI-ITYLOYPMSA-NSynonyms
(5Z)3BENZYL5((2(4BENZYLPIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3benzyl5((2(4benzylpiperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(4benzylpiperazin1yl)7methyl4Hpyrido(12a)pyrimidin4one
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)N5CCN(CC5)CC6=CC=CC=C6)C=C1
Cc1ccc2n(c1)c(=O)c(c(n2)N1CCN(CC1)Cc1ccccc1)C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC31H29N5O2S2c1221213273228(34161433(151734)20238425923)25(29(37)35(27)1922)182630(38)36(31(39)4026)2124106371124h2131819H14172021H21H3b2618
MFCD02987770
ZINC000100762022
ZINC100762022
Check stock
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Check stock on Vitas-MAvailable files
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