Vitas-M small molecule compound
N-[(2Z)-5-cyclobutyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-(2-methylpropyl)-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
Catalog ID
STL161139
SMILES CC(CN1C(=O)c2ccccc2N2C1(CCC2=O)C(=O)/N=c\1/[nH]nc(s1)C1CCC1)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 C22H25N5O3S MW 439.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O3S/c1-13(2)12-26-19(29)15-8-3-4-9-16(15)27-17(28)10-11-22(26,27)20(30)23-21-25-24-18(31-21)14-6-5-7-14/h3-4,8-9,13-14H,5-7,10-12H2,1-2H3,(H,23,25,30)InChIKey
HPGOSSAPDFPRGP-UHFFFAOYSA-NSynonyms
1282094-82-91282094829
CC(C)CN1C(=O)C2=CC=CC=C2N3C1(CCC3=O)C(=O)NC4=NN=C(S4)C5CCC5
CC(CN1C(=O)c2ccccc2N2C1(CCC2=O)C(=O)N=c1(nH)nc(s1)C1CCC1)C
InChI=1SC22H25N5O3Sc113(2)122619(29)15834916(15)2717(28)101122(2627)20(30)2321252418(3121)1465714h34891314H571012H212H3(H232530)
MFCD20759276
N((2Z)5cyclobutyl134thiadiazol2(3H)ylidene)4(2methylpropyl)15dioxo2345tetrahydropyrrolo(12a)quinazoline3a(1H)carboxamide
N(5cyclobutyl134thiadiazol2yl)4(2methylpropyl)15dioxo23dihydropyrrolo(12a)quinazoline3acarboxamide
ZINC000061720314
ZINC000061720315
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