Vitas-M small molecule compound

(6E)-6-{[1-(2-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-[2-(morpholin-4-yl)-2-oxoethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Catalog ID
STK659691
SMILES CCc1ccccc1n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCOCC1

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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 C26H28N6O3S MW 504.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6O3S/c1-4-18-7-5-6-8-21(18)31-16(2)13-19(17(31)3)14-20-24(27)32-26(28-25(20)34)36-22(29-32)15-23(33)30-9-11-35-12-10-30/h5-8,13-14,27H,4,9-12,15H2,1-3H3/b20-14+,27-24-
InChIKey
DEWVEOAKBDJTOB-RQGKAJNZSA-N
Synonyms
866492-12-8
(6E)6((1(2ethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(2(morpholin4yl)2oxoethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(2ethylphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2(2morpholino2oxoethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
866492128
CCc1ccccc1n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCOCC1
MFCD05706039
ZINC000009293674

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Available files

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