Vitas-M small molecule compound
(6Z)-6-{[1-(2,4-dichlorophenyl)-2,5-dimethyl-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
STL224620
SMILES Clc1ccc(c(c1)Cl)n1c(C)cc(c1C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)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 C21H19Cl2N5OS MW 460.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl2N5OS/c1-10(2)20-26-28-18(24)15(19(29)25-21(28)30-20)8-13-7-11(3)27(12(13)4)17-6-5-14(22)9-16(17)23/h5-10,24H,1-4H3/b15-8-,24-18-InChIKey
YVCZMGIGVJQJOE-XEHBIMHZSA-NSynonyms
(6Z)6((1(24dichlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(propan2yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(24dichlorophenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2isopropyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
Clc1ccc(c(c1)Cl)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)C(C)C
MFCD24857835
ZINC000041083214
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