Vitas-M small molecule compound
(6E)-6-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-hexyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224688
SMILES CCCCCCc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3ccc(cc3)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 C24H26ClN5OS MW 468.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26ClN5OS/c1-4-5-6-7-8-21-28-30-22(26)20(23(31)27-24(30)32-21)14-17-13-15(2)29(16(17)3)19-11-9-18(25)10-12-19/h9-14,26H,4-8H2,1-3H3/b20-14+,26-22-InChIKey
SAQYLXDGRVTGOA-RPNQXIDZSA-NSynonyms
877795-39-6(6E)6((1(4chlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)2hexyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(4chlorophenyl)25dimethyl1Hpyrrol3yl)methylene)2hexyl5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
877795396
CCCCCCc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3ccc(cc3)Cl)C)C2=N)s1
MFCD05703016
ZINC000009293473
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