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1-(2-{6-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-3-ethyl-1-methylthiourea

Catalog ID
STK556421
SMILES CCNC(=S)N(CCc1cc2OCOc2c(c1C=C1C(=O)N(C)C(=O)N(C1=O)C)OC)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 C21H26N4O6S MW 462.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O6S/c1-6-22-20(32)23(2)8-7-12-9-15-17(31-11-30-15)16(29-5)13(12)10-14-18(26)24(3)21(28)25(4)19(14)27/h9-10H,6-8,11H2,1-5H3,(H,22,32)
InChIKey
ODWRSMXXMLIURK-UHFFFAOYSA-N
Synonyms
573697-76-4
1(2(6((13DIMETHYL246TRIOXO13DIAZINAN5YLIDENE)METHYL)7METHOXY13BENZODIOXOL5YL)ETHYL)3ETHYL1METHYLTHIOUREA
1(2(6((13dimethyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)7methoxy13benzodioxol5yl)ethyl)3ethyl1methylthiourea
1(2(6((13dimethyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)7methoxybenzo(d)(13)dioxol5yl)ethyl)3ethyl1methylthiourea
1(2(6((13DIMETHYL246TRIS(OXIDANYLIDENE)13DIAZINAN5YLIDENE)METHYL)7METHOXY13BENZODIOXOL5YL)ETHYL)3ETHYL1METHYLTHIOUREA
1(2(6(13DIMETHYL246TRIOXOTETRAHYDROPYRIMIDIN5YLIDENEMETHYL)7METHOXYBENZO(13)DIOXOL5YL)ETHYL)3ETHYL1METHYLTHIOUREA
3ETHYL1(2(7METHOXY6((246TRIKETO13DIMETHYLHEXAHYDROPYRIMIDIN5YLIDENE)METHYL)13BENZODIOXOL5YL)ETHYL)1METHYLTHIOUREA
573697764
CCNC(=S)N(C)CCC1=CC2=C(C(=C1C=C3C(=O)N(C(=O)N(C3=O)C)C)OC)OCO2
InChI=1SC21H26N4O6Sc162220(32)23(2)871291517(31113015)16(295)13(12)101418(26)24(3)21(28)25(4)19(14)27h910H6811H215H3(H2232)
MFCD04017882
ZINC000013865122
ZINC13865122

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Available files

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