Vitas-M small molecule compound
1-acetyl-6'-amino-2-oxo-3'-(thiophen-2-yl)-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Catalog ID
STK766168
SMILES N#CC1=C(N)Oc2c(C31C(=O)N(c1c3cccc1)C(=O)C)c(n[nH]2)c1cccs1
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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 C20H13N5O3S MW 403.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N5O3S/c1-10(26)25-13-6-3-2-5-11(13)20(19(25)27)12(9-21)17(22)28-18-15(20)16(23-24-18)14-7-4-8-29-14/h2-8H,22H2,1H3,(H,23,24)InChIKey
YKWMODWLIGZGRH-UHFFFAOYSA-NSynonyms
10ACETYL6AMINO11OXO3(2THIENYL)SPIRO(4HPYRANO(32D)PYRAZOLE43INDOLINE)5CARBONITRILE
1acetyl6amino2oxo3(thiophen2yl)12dihydro1Hspiro(indole34pyrano(23c)pyrazole)5carbonitrile
1ACETYL6AMINO2OXO3THIOPHEN2YLSPIRO(2HPYRANO(23C)PYRAZOLE43INDOLE)5CARBONITRILE
CC(=O)N1C2=CC=CC=C2C3(C1=O)C(=C(OC4=NNC(=C34)C5=CC=CS5)N)C#N
InChI=1SC20H13N5O3Sc110(26)2513632511(13)20(19(25)27)12(921)17(22)281815(20)16(232418)147482914h28H22H21H3(H2324)
MFCD03035946
N#CC1=C(N)Oc2c(C31C(=O)N(c1c3cccc1)C(=O)C)c(n(nH)2)c1cccs1
ZINC000004168836
ZINC000004168838
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