Vitas-M small molecule compound
(6Z)-6-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}benzylidene)-5-imino-2-(phenoxymethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK385666
SMILES CCC(c1ccc(cc1)OCCOc1ccc(cc1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1)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 C31H30N4O4S MW 554.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O4S/c1-3-21(2)23-11-15-26(16-12-23)38-18-17-37-25-13-9-22(10-14-25)19-27-29(32)35-31(33-30(27)36)40-28(34-35)20-39-24-7-5-4-6-8-24/h4-16,19,21,32H,3,17-18,20H2,1-2H3/b27-19-,32-29-InChIKey
NRZJEZHTBSQPDJ-GKVAMIOZSA-NSynonyms
(6Z)6(4(2(4(butan2yl)phenoxy)ethoxy)benzylidene)5imino2(phenoxymethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCC(c1ccc(cc1)OCCOc1ccc(cc1)C=C1C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1)C
MFCD02914718
ZINC000097964056
ZINC000097964057
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