Vitas-M small molecule compound
2'-amino-5,7',7'-trimethyl-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
STK778368
SMILES N#CC1=C(N)N(c2nnc(s2)SC)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 C23H22N6O2S2 MW 478.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N6O2S2/c1-11-5-6-14-12(7-11)23(19(31)26-14)13(10-24)18(25)29(20-27-28-21(32-4)33-20)15-8-22(2,3)9-16(30)17(15)23/h5-7H,8-9,25H2,1-4H3,(H,26,31)InChIKey
ZRTUUDMQPZUJBY-UHFFFAOYSA-NSynonyms
2amino577trimethyl1(5(methylsulfanyl)134thiadiazol2yl)25dioxo125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
2amino577trimethyl1(5methylsulfanyl134thiadiazol2yl)25dioxospiro(1Hindole3468dihydroquinoline)3carbonitrile
CC1=CC2=C(C=C1)NC(=O)C23C(=C(N(C4=C3C(=O)CC(C4)(C)C)C5=NN=C(S5)SC)N)C#N
InChI=1SC23H22N6O2S2c111561412(711)23(19(31)2614)13(1024)18(25)29(20272821(324)3320)15822(23)916(30)17(15)23h57H8925H214H3(H2631)
MFCD05856467
ZINC000012462560
ZINC000012462561
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