Vitas-M small molecule compound
1-(2-chlorobenzyl)-2,5'-dioxo-1'-phenyl-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Catalog ID
STK686746
SMILES N#CC1=C(n2cccc2)N(c2ccccc2)C2=C(C31c1ccccc1N(C3=O)Cc1ccccc1Cl)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 C34H25ClN4O2 MW 557.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H25ClN4O2/c35-27-15-6-4-11-23(27)22-38-28-16-7-5-14-25(28)34(33(38)41)26(21-36)32(37-19-8-9-20-37)39(24-12-2-1-3-13-24)29-17-10-18-30(40)31(29)34/h1-9,11-16,19-20H,10,17-18,22H2InChIKey
KJBRTNRGJOJVJJ-UHFFFAOYSA-NSynonyms
1((2CHLOROPHENYL)METHYL)25DIOXO1PHENYL2PYRROL1YLSPIRO(78DIHYDRO6HQUINOLINE43INDOLE)3CARBONITRILE
1(2chlorobenzyl)25dioxo1phenyl2(1Hpyrrol1yl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
C1CC2=C(C(=O)C1)C3(C4=CC=CC=C4N(C3=O)CC5=CC=CC=C5Cl)C(=C(N2C6=CC=CC=C6)N7C=CC=C7)C#N
InChI=1SC34H25ClN4O2c352715641123(27)22382816751425(28)34(33(38)41)26(2136)32(3719892037)39(24122131324)2917101830(40)31(29)34h1911161920H10171822H2
MFCD06017400
ZINC000098008049
ZINC000098008050
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