Vitas-M small molecule compound
1,5-dioxo-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
Catalog ID
STK941372
SMILES CC(c1n[nH]/c(=N/C(=O)C23CCC(=O)N3c3c(C(=O)N2)cccc3)/s1)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 C17H17N5O3S MW 371.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O3S/c1-9(2)14-20-21-16(26-14)18-15(25)17-8-7-12(23)22(17)11-6-4-3-5-10(11)13(24)19-17/h3-6,9H,7-8H2,1-2H3,(H,19,24)(H,18,21,25)InChIKey
JTPXYRMHSBLQGI-UHFFFAOYSA-NSynonyms
1236261-18-91236261189
15dioxoN((2Z)5(propan2yl)134thiadiazol2(3H)ylidene)2345tetrahydropyrrolo(12a)quinazoline3a(1H)carboxamide
15dioxoN(5propan2yl134thiadiazol2yl)34dihydro2Hpyrrolo(12a)quinazoline3acarboxamide
CC(C)C1=NN=C(S1)NC(=O)C23CCC(=O)N2C4=CC=CC=C4C(=O)N3
CC(c1n(nH)c(=NC(=O)C23CCC(=O)N3c3c(C(=O)N2)cccc3)s1)C
InChI=1SC17H17N5O3Sc19(2)14202116(2614)1815(25)178712(23)22(17)11643510(11)13(24)1917h369H78H212H3(H1924)(H182125)
MFCD18179789
ZINC000040286547
ZINC000040286548
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