Vitas-M small molecule compound
(6E)-2-(4-chlorobenzyl)-6-{[2,5-dimethyl-1-(2-methylphenyl)-1H-pyrrol-3-yl]methylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL225076
SMILES Clc1ccc(cc1)Cc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3ccccc3C)C)/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 C26H22ClN5OS MW 488.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN5OS/c1-15-6-4-5-7-22(15)31-16(2)12-19(17(31)3)14-21-24(28)32-26(29-25(21)33)34-23(30-32)13-18-8-10-20(27)11-9-18/h4-12,14,28H,13H2,1-3H3/b21-14+,28-24-InChIKey
SCDSMBDPXAUUKV-RUKGZDQOSA-NSynonyms
847339-63-3(6E)2(4chlorobenzyl)6((25dimethyl1(2methylphenyl)1Hpyrrol3yl)methylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)2(4chlorobenzyl)6((25dimethyl1(otolyl)1Hpyrrol3yl)methylene)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
847339633
Clc1ccc(cc1)Cc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3ccccc3C)C)C2=N)s1
MFCD04180174
ZINC000009158717
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