Vitas-M small molecule compound
(3aR)-4-butyl-N-[(2Z)-4-methyl-1,3-thiazol-2(3H)-ylidene]-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
Catalog ID
STL536196
SMILES CCCCN1C(=O)c2ccccc2N2[C@]1(CCC2=O)C(=O)/N=c/1\scc([nH]1)C
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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 C20H22N4O3S MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3S/c1-3-4-11-23-17(26)14-7-5-6-8-15(14)24-16(25)9-10-20(23,24)18(27)22-19-21-13(2)12-28-19/h5-8,12H,3-4,9-11H2,1-2H3,(H,21,22,27)/t20-/m1/s1InChIKey
QRNRMVJRXLKZDY-HXUWFJFHSA-NSynonyms
1220102-49-7(3~(a)~(R))4butyl~(N)(4methyl13thiazol2yl)15dioxo23dihydropyrrolo(12a)quinazoline3~(a)carboxamide
(3aR)4butylN((2Z)4methyl13thiazol2(3H)ylidene)15dioxo2345tetrahydropyrrolo(12a)quinazoline3a(1H)carboxamide
1220102497
49652417
InChI=1SC20H22N4O3Sc134112317(26)14756815(14)2416(25)91020(2324)18(27)22192113(2)122819h5812H34911H212H3(H212227)t20m1s1
ZINC000040310311
ZINC40310311
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