Vitas-M small molecule compound

2'-amino-1,7',7'-trimethyl-2,5'-dioxo-1'-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile

Catalog ID
STK778391
SMILES N#CC1=C(N)N(c2nnc(s2)SC(C)C)C2=C(C31c1ccccc1N(C3=O)C)C(=O)CC(C2)(C)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 C25H26N6O2S2 MW 506.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N6O2S2/c1-13(2)34-23-29-28-22(35-23)31-17-10-24(3,4)11-18(32)19(17)25(15(12-26)20(31)27)14-8-6-7-9-16(14)30(5)21(25)33/h6-9,13H,10-11,27H2,1-5H3
InChIKey
AZMADIRUPOTRGZ-UHFFFAOYSA-N
Synonyms

2amino177trimethyl25dioxo1(5(propan2ylsulfanyl)134thiadiazol2yl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
2AMINO177TRIMETHYL25DIOXO1(5PROPAN2YLSULFANYL134THIADIAZOL2YL)SPIRO(68DIHYDROQUINOLINE43INDOLE)3CARBONITRILE
CC(C)SC1=NN=C(S1)N2C3=C(C(=O)CC(C3)(C)C)C4(C5=CC=CC=C5N(C4=O)C)C(=C2N)C#N
InChI=1SC25H26N6O2S2c113(2)3423292822(3523)31171024(34)1118(32)19(17)25(15(1226)20(31)27)14867916(14)30(5)21(25)33h6913H101127H215H3
MFCD05856506
ZINC000012401669
ZINC000012401670

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Available files

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