Vitas-M small molecule compound
(6Z)-5-imino-6-[4-(naphthalen-1-ylmethoxy)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
STL236314
SMILES O=C(N1CCCC1)Cc1nn2c(=NC(=O)/C(=C\c3ccc(cc3)OCc3cccc4c3cccc4)/C2=N)s1
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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 C29H25N5O3S MW 523.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N5O3S/c30-27-24(28(36)31-29-34(27)32-25(38-29)17-26(35)33-14-3-4-15-33)16-19-10-12-22(13-11-19)37-18-21-8-5-7-20-6-1-2-9-23(20)21/h1-2,5-13,16,30H,3-4,14-15,17-18H2/b24-16-,30-27-InChIKey
VUGLRNOFMGOXNX-PUNADZHJSA-NSynonyms
844853-27-6(6Z)5imino6(4(naphthalen1ylmethoxy)benzylidene)2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)5imino6(4(naphthalen1ylmethoxy)benzylidene)2(2oxo2(pyrrolidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
844853276
MFCD04164600
O=C(N1CCCC1)Cc1nn2c(=NC(=O)C(=Cc3ccc(cc3)OCc3cccc4c3cccc4)C2=N)s1
ZINC000009281087
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