Vitas-M small molecule compound
2'-amino-1'-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,5'-dioxo-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Catalog ID
STK778412
SMILES N#CC1=C(N)N(c2nnc(s2)SC)C2=C(C31C(=O)Nc1c3cccc1)C(=O)CCC2
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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 C20H16N6O2S2 MW 436.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N6O2S2/c1-29-19-25-24-18(30-19)26-13-7-4-8-14(27)15(13)20(11(9-21)16(26)22)10-5-2-3-6-12(10)23-17(20)28/h2-3,5-6H,4,7-8,22H2,1H3,(H,23,28)InChIKey
UTQNKCXRLGSRRU-UHFFFAOYSA-NSynonyms
2amino1(5(methylsulfanyl)134thiadiazol2yl)25dioxo125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
2amino1(5methylsulfanyl134thiadiazol2yl)25dioxospiro(1Hindole3478dihydro6Hquinoline)3carbonitrile
CSC1=NN=C(S1)N2C3=C(C(=O)CCC3)C4(C5=CC=CC=C5NC4=O)C(=C2N)C#N
InChI=1SC20H16N6O2S2c12919252418(3019)261374814(27)15(13)20(11(921)16(26)22)10523612(10)2317(20)28h2356H47822H21H3(H2328)
MFCD05856566
ZINC000012371924
ZINC000012371925
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