Vitas-M small molecule compound
3-{(Z)-[3-(4-methoxybenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[4-(4-methoxyphenyl)piperazin-1-yl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK798414
SMILES COc1ccc(cc1)CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccc(cc2)OC)/C1=O
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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 C32H31N5O4S2 MW 613.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N5O4S2/c1-21-5-4-14-36-28(21)33-29(35-17-15-34(16-18-35)23-8-12-25(41-3)13-9-23)26(30(36)38)19-27-31(39)37(32(42)43-27)20-22-6-10-24(40-2)11-7-22/h4-14,19H,15-18,20H2,1-3H3/b27-19-InChIKey
XPOCHNXVAKHVSH-DIBXZPPDSA-NSynonyms
(5Z)3((4METHOXYPHENYL)METHYL)5((2(4(4METHOXYPHENYL)PIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3(4methoxybenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4(4methoxyphenyl)piperazin1yl)9methyl4Hpyrido(12a)pyrimidin4one
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)OC)N5CCN(CC5)C6=CC=C(C=C6)OC
COc1ccc(cc1)CN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccc(cc2)OC)C1=O
InChI=1SC32H31N5O4S2c12154143628(21)3329(35171534(161835)2381225(413)13923)26(30(36)38)192731(39)37(32(42)4327)202261024(402)11722h41419H151820H213H3b2719
MFCD03461970
ZINC000097946379
ZINC97946379
Check stock
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Check stock on Vitas-MAvailable files
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