Vitas-M small molecule compound
2'-amino-5,7',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
STK778740
SMILES N#CC1=C(N)N(c2nnc(s2)SC(C)C)C2=C(C31C(=O)Nc1c3cc(C)cc1)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/c1-12(2)34-23-30-29-22(35-23)31-17-9-24(4,5)10-18(32)19(17)25(15(11-26)20(31)27)14-8-13(3)6-7-16(14)28-21(25)33/h6-8,12H,9-10,27H2,1-5H3,(H,28,33)InChIKey
GQWCEVQDGNXWCB-UHFFFAOYSA-NSynonyms
2amino577trimethyl25dioxo1(5(propan2ylsulfanyl)134thiadiazol2yl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
2amino577trimethyl25dioxo1(5propan2ylsulfanyl134thiadiazol2yl)spiro(1Hindole3468dihydroquinoline)3carbonitrile
CC1=CC2=C(C=C1)NC(=O)C23C(=C(N(C4=C3C(=O)CC(C4)(C)C)C5=NN=C(S5)SC(C)C)N)C#N
InChI=1SC25H26N6O2S2c112(2)3423302922(3523)3117924(45)1018(32)19(17)25(15(1126)20(31)27)14813(3)6716(14)2821(25)33h6812H91027H215H3(H2833)
MFCD05857054
ZINC000012462558
ZINC000012462559
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