Vitas-M small molecule compound
(6E)-5-imino-6-{[1-(3-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL239116
SMILES COc1cccc(c1)n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1
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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 C25H26N6O3S MW 490.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N6O3S/c1-15-11-17(16(2)30(15)18-7-6-8-19(13-18)34-3)12-20-23(26)31-25(27-24(20)33)35-21(28-31)14-22(32)29-9-4-5-10-29/h6-8,11-13,26H,4-5,9-10,14H2,1-3H3/b20-12+,26-23-InChIKey
ORNVBLLVKZWKSL-BYVRFLJOSA-NSynonyms
848929-98-6(6E)5imino6((1(3methoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino6((1(3methoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)2(2oxo2(pyrrolidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
848929986
COc1cccc(c1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1
MFCD05678131
ZINC000009232892
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