Vitas-M small molecule compound
4-[(Z)-(2-benzyl-5-imino-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2-methoxyphenyl thiophene-2-carboxylate
Catalog ID
STK076062
SMILES COc1cc(ccc1OC(=O)c1cccs1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)Cc1ccccc1
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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 C25H18N4O4S2 MW 502.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N4O4S2/c1-32-19-13-16(9-10-18(19)33-24(31)20-8-5-11-34-20)12-17-22(26)29-25(27-23(17)30)35-21(28-29)14-15-6-3-2-4-7-15/h2-13,26H,14H2,1H3/b17-12-,26-22-InChIKey
UPTUWTVSGDMIFP-OTNSQLAVSA-NSynonyms
4((Z)(2benzyl5imino7oxo5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)2methoxyphenylthiophene2carboxylate
COc1cc(ccc1OC(=O)c1cccs1)C=C1C(=O)N=c2n(C1=N)nc(s2)Cc1ccccc1
MFCD08672703
STK076062
ZINC000009659791
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