Vitas-M small molecule compound
(6Z)-5-imino-6-{4-[2-(4-methylphenoxy)ethoxy]benzylidene}-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL154422
SMILES Cc1ccc(cc1)OCCOc1ccc(cc1)/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 C27H27N5O4S MW 517.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O4S/c1-18-4-8-20(9-5-18)35-14-15-36-21-10-6-19(7-11-21)16-22-25(28)32-27(29-26(22)34)37-23(30-32)17-24(33)31-12-2-3-13-31/h4-11,16,28H,2-3,12-15,17H2,1H3/b22-16-,28-25-InChIKey
XSTVLBUPUKZZJI-SVLBQRFGSA-NSynonyms
848062-67-9(6Z)5imino6(4(2(4methylphenoxy)ethoxy)benzylidene)2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)5imino2(2oxo2(pyrrolidin1yl)ethyl)6(4(2(ptolyloxy)ethoxy)benzylidene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
848062679
Cc1ccc(cc1)OCCOc1ccc(cc1)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1
MFCD04187177
ZINC000009185387
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