Vitas-M small molecule compound
(6Z)-6-{[2,5-dimethyl-1-(naphthalen-1-yl)-1H-pyrrol-3-yl]methylidene}-5-imino-2-(propan-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK005123
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1cc(n(c1C)c1cccc2c1cccc2)C)C(C)C
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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 C25H23N5OS MW 441.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5OS/c1-14(2)24-28-30-22(26)20(23(31)27-25(30)32-24)13-18-12-15(3)29(16(18)4)21-11-7-9-17-8-5-6-10-19(17)21/h5-14,26H,1-4H3/b20-13-,26-22-InChIKey
ZLDAHPXUGYLZLW-KZPCVOCJSA-NSynonyms
(6Z)6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylidene)5imino2(propan2yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylene)5imino2isopropyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
MFCD03079084
O=C1N=c2sc(nn2C(=N)C1=Cc1cc(n(c1C)c1cccc2c1cccc2)C)C(C)C
STK005123
ZINC000008453476
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