Vitas-M small molecule compound
(6Z)-5-imino-6-{4-[3-(4-methylphenoxy)propoxy]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
STL236500
SMILES Cc1ccc(cc1)OCCCOc1ccc(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 C28H29N5O4S MW 531.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O4S/c1-19-5-9-21(10-6-19)36-15-4-16-37-22-11-7-20(8-12-22)17-23-26(29)33-28(30-27(23)35)38-24(31-33)18-25(34)32-13-2-3-14-32/h5-12,17,29H,2-4,13-16,18H2,1H3/b23-17-,29-26-InChIKey
PBEFHLIJZLUAIY-VVAKSVJXSA-NSynonyms
846030-28-2(6Z)5imino6(4(3(4methylphenoxy)propoxy)benzylidene)2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)5imino2(2oxo2(pyrrolidin1yl)ethyl)6(4(3(ptolyloxy)propoxy)benzylidene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
846030282
Cc1ccc(cc1)OCCCOc1ccc(cc1)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1
MFCD04172564
ZINC000101123176
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