Vitas-M small molecule compound
(6E)-6-{[1-(3,5-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-(3-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224685
SMILES Cc1cccc(c1)c1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3cc(C)cc(c3)C)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 C27H25N5OS MW 467.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5OS/c1-15-7-6-8-20(10-15)26-30-32-24(28)23(25(33)29-27(32)34-26)14-21-13-18(4)31(19(21)5)22-11-16(2)9-17(3)12-22/h6-14,28H,1-5H3/b23-14+,28-24-InChIKey
YOUBTFVGNFMYAI-MOEACLASSA-NSynonyms
847377-86-0(6E)6((1(35dimethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(3methylphenyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(35dimethylphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2(mtolyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
847377860
Cc1cccc(c1)c1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3cc(C)cc(c3)C)C)C2=N)s1
MFCD04181393
ZINC000009159032
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