Vitas-M small molecule compound
(6E)-6-{[1-(3-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-pentyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224561
SMILES CCCCCc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3cccc(c3)Cl)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 C23H24ClN5OS MW 454.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24ClN5OS/c1-4-5-6-10-20-27-29-21(25)19(22(30)26-23(29)31-20)12-16-11-14(2)28(15(16)3)18-9-7-8-17(24)13-18/h7-9,11-13,25H,4-6,10H2,1-3H3/b19-12+,25-21-InChIKey
COYHUSGCFCVTFW-QMBPPXPRSA-NSynonyms
862126-96-3(6E)6((1(3chlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2pentyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(3chlorophenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2pentyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
862126963
CCCCCc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3cccc(c3)Cl)C)C2=N)s1
MFCD05687384
ZINC000009309454
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