Vitas-M small molecule compound
(6E)-6-{[1-(5-chloro-2,4-dimethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224472
SMILES COc1cc(OC)c(cc1n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)ncs2)Cl
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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 C20H18ClN5O3S MW 443.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN5O3S/c1-10-5-12(6-13-18(22)26-20(24-19(13)27)30-9-23-26)11(2)25(10)15-7-14(21)16(28-3)8-17(15)29-4/h5-9,22H,1-4H3/b13-6+,22-18-InChIKey
MUJCKHJCMHKQFZ-KPODIUMYSA-NSynonyms
861122-51-2(6E)6((1(5chloro24dimethoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(5chloro24dimethoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
861122512
COc1cc(OC)c(cc1n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)ncs2)Cl
MFCD05683452
ZINC000009307790
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