Vitas-M small molecule compound
2-[(3-hydroxypropyl)amino]-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK876444
SMILES OCCCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC=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 C18H18N4O3S2 MW 402.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O3S2/c1-2-8-22-17(25)13(27-18(22)26)11-12-15(19-7-5-10-23)20-14-6-3-4-9-21(14)16(12)24/h2-4,6,9,11,19,23H,1,5,7-8,10H2/b13-11-InChIKey
QGMQIWLCEVQBPT-QBFSEMIESA-NSynonyms
(5Z)5((2(3HYDROXYPROPYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3allyl5((2((3hydroxypropyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
2((3hydroxypropyl)amino)3((Z)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
C=CCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCCCO)SC1=S
InChI=1SC18H18N4O3S2c1282217(25)13(2718(22)26)111215(19751023)2014634921(14)16(12)24h2469111923H157810H2b1311
MFCD02993593
OCCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CC=C
ZINC000001815746
ZINC1815746
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