Vitas-M small molecule compound
N-[4-({5-[(Z)-(1-butyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]-2-methoxybenzyl}oxy)phenyl]acetamide
Catalog ID
STL148175
SMILES CCCCN1C(=NC(=O)/C(=C/c2ccc(c(c2)COc2ccc(cc2)NC(=O)C)OC)/C1=O)S
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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 C25H27N3O5S MW 481.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O5S/c1-4-5-12-28-24(31)21(23(30)27-25(28)34)14-17-6-11-22(32-3)18(13-17)15-33-20-9-7-19(8-10-20)26-16(2)29/h6-11,13-14H,4-5,12,15H2,1-3H3,(H,26,29)(H,27,30,34)/b21-14-InChIKey
DQHAKPJQMQCGEW-STZFKDTASA-NSynonyms
374550-34-2374550342
CCCCN1C(=NC(=O)C(=Cc2ccc(c(c2)COc2ccc(cc2)NC(=O)C)OC)C1=O)S
CCCCN1C(=O)C(=CC2=CC(=C(C=C2)OC)COC3=CC=C(C=C3)NC(=O)C)C(=O)NC1=S
InChI=1SC25H27N3O5Sc145122824(31)21(23(30)2725(28)34)141761122(323)18(1317)1533209719(81020)2616(2)29h6111314H451215H213H3(H2629)(H273034)b2114
MFCD03799759
N(4((5((Z)(1butyl46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)2methoxybenzyl)oxy)phenyl)acetamide
N(4((5((Z)(1BUTYL46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENYL)METHOXY)PHENYL)ACETAMIDE
ZINC000009339731
ZINC09339731
ZINC9339731
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