Vitas-M small molecule compound
N-[(2Z)-5-cyclobutyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-(3-methylbutyl)-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
Catalog ID
STL153654
SMILES CC(CCN1C(=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 C23H27N5O3S MW 453.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O3S/c1-14(2)11-13-27-20(30)16-8-3-4-9-17(16)28-18(29)10-12-23(27,28)21(31)24-22-26-25-19(32-22)15-6-5-7-15/h3-4,8-9,14-15H,5-7,10-13H2,1-2H3,(H,24,26,31)InChIKey
YTUGRLVQHOSJHR-UHFFFAOYSA-NSynonyms
1282094-74-91282094749
CC(C)CCN1C(=O)C2=CC=CC=C2N3C1(CCC3=O)C(=O)NC4=NN=C(S4)C5CCC5
CC(CCN1C(=O)c2ccccc2N2C1(CCC2=O)C(=O)N=c1(nH)nc(s1)C1CCC1)C
InChI=1SC23H27N5O3Sc114(2)11132720(30)16834917(16)2818(29)101223(2728)21(31)2422262519(3222)1565715h34891415H571013H212H3(H242631)
MFCD20756744
N((2Z)5cyclobutyl134thiadiazol2(3H)ylidene)4(3methylbutyl)15dioxo2345tetrahydropyrrolo(12a)quinazoline3a(1H)carboxamide
N(5cyclobutyl134thiadiazol2yl)4(3methylbutyl)15dioxo23dihydropyrrolo(12a)quinazoline3acarboxamide
ZINC000061720950
ZINC000061720951
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