Vitas-M small molecule compound
(6Z)-6-{3-[2-(4-tert-butylphenoxy)ethoxy]benzylidene}-2-cyclohexyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK385663
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1cccc(c1)OCCOc1ccc(cc1)C(C)(C)C)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 C30H34N4O3S MW 530.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O3S/c1-30(2,3)22-12-14-23(15-13-22)36-16-17-37-24-11-7-8-20(18-24)19-25-26(31)34-29(32-27(25)35)38-28(33-34)21-9-5-4-6-10-21/h7-8,11-15,18-19,21,31H,4-6,9-10,16-17H2,1-3H3/b25-19-,31-26-InChIKey
DBGNZMSPYVVQOR-RWXWESCMSA-NSynonyms
(6Z)6(3(2(4tertbutylphenoxy)ethoxy)benzylidene)2cyclohexyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
MFCD02914709
O=C1N=c2sc(nn2C(=N)C1=Cc1cccc(c1)OCCOc1ccc(cc1)C(C)(C)C)C1CCCCC1
ZINC000008721917
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