Vitas-M small molecule compound
2-(2-methoxy-5-{(Z)-[1-(2-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}benzyl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STL039618
SMILES COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1C)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 C28H21N3O5S MW 511.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N3O5S/c1-16-7-3-6-10-22(16)31-27(35)21(24(32)29-28(31)37)14-17-11-12-23(36-2)18(13-17)15-30-25(33)19-8-4-5-9-20(19)26(30)34/h3-14H,15H2,1-2H3,(H,29,32,37)/b21-14-InChIKey
YZNZWIXNWIJEKM-STZFKDTASA-NSynonyms
372498-13-02((2METHOXY5((Z)(1(2METHYLPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENYL)METHYL)ISOINDOLE13DIONE
2(2methoxy5((Z)(1(2methylphenyl)46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)benzyl)1Hisoindole13(2H)dione
372498130
CC1=CC=CC=C1N2C(=O)C(=CC3=CC(=C(C=C3)OC)CN4C(=O)C5=CC=CC=C5C4=O)C(=O)NC2=S
COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)C=C1C(=O)N=C(N(C1=O)c1ccccc1C)S
InChI=1SC28H21N3O5Sc1167361022(16)3127(35)21(24(32)2928(31)37)1417111223(362)18(1317)153025(33)19845920(19)26(30)34h314H15H212H3(H293237)b2114
MFCD03796754
ZINC000013765402
ZINC08921322
ZINC13765402
Check stock
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