Vitas-M small molecule compound
N-[(2Z)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
Catalog ID
STK937547
SMILES COCc1n[nH]/c(=N/C(=O)C23CCC(=O)N3c3c(C(=O)N2)cccc3)/s1
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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 C16H15N5O4S MW 373.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N5O4S/c1-25-8-11-19-20-15(26-11)17-14(24)16-7-6-12(22)21(16)10-5-3-2-4-9(10)13(23)18-16/h2-5H,6-8H2,1H3,(H,18,23)(H,17,20,24)InChIKey
LXQLPDFMDQUYNF-UHFFFAOYSA-NSynonyms
1246041-07-51246041075
COCC1=NN=C(S1)NC(=O)C23CCC(=O)N2C4=CC=CC=C4C(=O)N3
COCc1n(nH)c(=NC(=O)C23CCC(=O)N3c3c(C(=O)N2)cccc3)s1
InChI=1SC16H15N5O4Sc125811192015(2611)1714(24)167612(22)21(16)1053249(10)13(23)1816h25H68H21H3(H1823)(H172024)
MFCD18178707
N((2Z)5(methoxymethyl)134thiadiazol2(3H)ylidene)15dioxo2345tetrahydropyrrolo(12a)quinazoline3a(1H)carboxamide
N(5(methoxymethyl)134thiadiazol2yl)15dioxo34dihydro2Hpyrrolo(12a)quinazoline3acarboxamide
ZINC000040268272
ZINC000040268273
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