Vitas-M small molecule compound
(6Z)-6-{[1-(2,5-dimethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-(2-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK712761
SMILES COc1ccc(c(c1)n1c(C)cc(c1C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1ccccc1C)OC
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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 C27H25N5O3S MW 499.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O3S/c1-15-8-6-7-9-20(15)26-30-32-24(28)21(25(33)29-27(32)36-26)13-18-12-16(2)31(17(18)3)22-14-19(34-4)10-11-23(22)35-5/h6-14,28H,1-5H3/b21-13-,28-24-InChIKey
SNMIGBVQQMYHFL-BSAKSWINSA-NSynonyms
(6Z)6((1(25dimethoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(2methylphenyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(25dimethoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2(otolyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
COc1ccc(c(c1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccccc1C)OC
MFCD13371488
ZINC000034377800
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