Vitas-M small molecule compound
6-[(5Z)-4-oxo-5-({4-oxo-2-[(2-phenylethyl)amino]-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid
Catalog ID
STK794321
SMILES OC(=O)CCCCCN1C(=S)S/C(=C\c2c(NCCc3ccccc3)nc3n(c2=O)cccc3)/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 C26H26N4O4S2 MW 522.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O4S2/c31-22(32)12-5-2-7-16-30-25(34)20(36-26(30)35)17-19-23(27-14-13-18-9-3-1-4-10-18)28-21-11-6-8-15-29(21)24(19)33/h1,3-4,6,8-11,15,17,27H,2,5,7,12-14,16H2,(H,31,32)/b20-17-InChIKey
AVWDZTAIFWKUBZ-JZJYNLBNSA-NSynonyms
383898-61-1(Z)6(4oxo5((4oxo2(phenethylamino)4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin3yl)hexanoicacid
383898611
6((5Z)4oxo5((4oxo2((2phenylethyl)amino)4Hpyrido(12a)pyrimidin3yl)methylidene)2thioxo13thiazolidin3yl)hexanoicacid
6((5Z)4oxo5((4oxo2(2phenylethylamino)pyrido(12a)pyrimidin3yl)methylidene)2sulfanylidene13thiazolidin3yl)hexanoicacid
6((5Z)4OXO5((4OXO2(PHENETHYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
C1=CC=C(C=C1)CCNC2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CCCCCC(=O)O
InChI=1SC26H26N4O4S2c3122(32)12527163025(34)20(3626(30)35)171923(2714131893141018)282111681529(21)24(19)33h1346811151727H257121416H2(H3132)b2017
MFCD03283754
OC(=O)CCCCCN1C(=S)SC(=Cc2c(NCCc3ccccc3)nc3n(c2=O)cccc3)C1=O
ZINC000009122087
ZINC9122087
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