Vitas-M small molecule compound
2'-[(4-pentylphenyl)carbonyl]-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL053651
SMILES CCCCCc1ccc(cc1)C(=O)C1C(C(=O)c2cccs2)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2cccc1
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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 C36H32N2O3S MW 572.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H32N2O3S/c1-2-3-4-10-23-16-18-25(19-17-23)33(39)31-32(34(40)29-15-9-22-42-29)38-28-14-8-5-11-24(28)20-21-30(38)36(31)26-12-6-7-13-27(26)37-35(36)41/h5-9,11-22,30-32H,2-4,10H2,1H3,(H,37,41)InChIKey
JBAPVEUVVINPCP-UHFFFAOYSA-NSynonyms
(1S2S3R3aR)2(4pentylbenzoyl)1(thiophene2carbonyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
2((4pentylphenyl)carbonyl)1(thiophen2ylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
2(4pentylbenzoyl)1(thiophene2carbonyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
CCCCCC1=CC=C(C=C1)C(=O)C2C(N3C(C24C5=CC=CC=C5NC4=O)C=CC6=CC=CC=C63)C(=O)C7=CC=CS7
CCCCCc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)c2cccs2)N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=Cc1c2cccc1
InChI=1SC36H32N2O3Sc12341023161825(191723)33(39)3132(34(40)29159224229)382814851124(28)202130(38)36(31)2612671327(26)3735(36)41h5911223032H2410H21H3(H3741)
MFCD05736012
ZINC000102893326
ZINC000245246124
Check stock
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Check stock on Vitas-MAvailable files
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