Vitas-M small molecule compound
(6Z)-6-{4-[(4-chlorobenzyl)oxy]-3-methoxybenzylidene}-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK556698
SMILES COc1cc(ccc1OCc1ccc(cc1)Cl)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1
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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 C26H24ClN5O4S MW 538.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN5O4S/c1-35-21-13-17(6-9-20(21)36-15-16-4-7-18(27)8-5-16)12-19-24(28)32-26(29-25(19)34)37-22(30-32)14-23(33)31-10-2-3-11-31/h4-9,12-13,28H,2-3,10-11,14-15H2,1H3/b19-12-,28-24-InChIKey
BQSHIXZBXSNUAP-DPWHNAOOSA-NSynonyms
573933-04-7(6Z)6(4((4chlorobenzyl)oxy)3methoxybenzylidene)5imino2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(4((4chlorobenzyl)oxy)3methoxybenzylidene)5imino2(2oxo2(pyrrolidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
573933047
COc1cc(ccc1OCc1ccc(cc1)Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1
MFCD04019778
ZINC000101058057
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