Vitas-M small molecule compound
(6Z)-2-cyclohexyl-6-{4-[2-(2,6-dimethylphenoxy)ethoxy]-3-ethoxy-5-iodobenzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK007732
SMILES CCOc1cc(cc(c1OCCOc1c(C)cccc1C)I)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1
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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 C30H33IN4O4S MW 672.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33IN4O4S/c1-4-37-24-17-20(16-23(31)26(24)39-14-13-38-25-18(2)9-8-10-19(25)3)15-22-27(32)35-30(33-28(22)36)40-29(34-35)21-11-6-5-7-12-21/h8-10,15-17,21,32H,4-7,11-14H2,1-3H3/b22-15-,32-27-InChIKey
IMMORNYXMIQUHI-PCRQPTIZSA-NSynonyms
(6Z)2cyclohexyl6(4(2(26dimethylphenoxy)ethoxy)3ethoxy5iodobenzylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(cc(c1OCCOc1c(C)cccc1C)I)C=C1C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1
MFCD08049264
STK007732
ZINC000097957821
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