Vitas-M small molecule compound
4-[(Z)-{5-imino-7-oxo-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene}methyl]phenyl 4-methoxybenzoate
Catalog ID
STL234988
SMILES COc1ccc(cc1)C(=O)Oc1ccc(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 C26H23N5O5S MW 517.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O5S/c1-35-18-10-6-17(7-11-18)25(34)36-19-8-4-16(5-9-19)14-20-23(27)31-26(28-24(20)33)37-21(29-31)15-22(32)30-12-2-3-13-30/h4-11,14,27H,2-3,12-13,15H2,1H3/b20-14-,27-23-InChIKey
ASHDGVUXENGYKZ-XCAZPQICSA-NSynonyms
877787-67-2(Z)4((5imino7oxo2(2oxo2(pyrrolidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl4methoxybenzoate
4((Z)(5imino7oxo2(2oxo2(pyrrolidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl4methoxybenzoate
877787672
COc1ccc(cc1)C(=O)Oc1ccc(cc1)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1
MFCD05701572
ZINC000009345266
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