Vitas-M small molecule compound
(6Z)-6-{4-[(2-chlorobenzyl)oxy]benzylidene}-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL238974
SMILES O=C(N1CCCC1)Cc1nn2c(=NC(=O)/C(=C\c3ccc(cc3)OCc3ccccc3Cl)/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 C25H22ClN5O3S MW 508.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O3S/c26-20-6-2-1-5-17(20)15-34-18-9-7-16(8-10-18)13-19-23(27)31-25(28-24(19)33)35-21(29-31)14-22(32)30-11-3-4-12-30/h1-2,5-10,13,27H,3-4,11-12,14-15H2/b19-13-,27-23-InChIKey
DHHGSNZFLCVYBP-ILUWOZFOSA-NSynonyms
845809-06-5(6Z)6(4((2chlorobenzyl)oxy)benzylidene)5imino2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(4((2chlorobenzyl)oxy)benzylidene)5imino2(2oxo2(pyrrolidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
845809065
MFCD04170993
O=C(N1CCCC1)Cc1nn2c(=NC(=O)C(=Cc3ccc(cc3)OCc3ccccc3Cl)C2=N)s1
ZINC000009282045
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