Vitas-M small molecule compound
(1'R,3R,3'R)-1'-[(4-bromophenyl)carbonyl]-3'-(thiophen-2-ylcarbonyl)-3',3a'-dihydrospiro[indole-3,2'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STK538787
SMILES Brc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccs1
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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 C31H21BrN2O3S MW 581.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H21BrN2O3S/c32-20-14-11-19(12-15-20)27(35)29-31(21-7-2-3-8-22(21)33-30(31)37)26(28(36)25-10-5-17-38-25)24-16-13-18-6-1-4-9-23(18)34(24)29/h1-17,24,26,29H,(H,33,37)/t24?,26-,29+,31+/m1/s1InChIKey
IAAWHXLRSINBFD-IQAQFTNVSA-NSynonyms
(1R3R3R)1((4bromophenyl)carbonyl)3(thiophen2ylcarbonyl)33adihydrospiro(indole32pyrrolo(12a)quinolin)2(1H)one
(1R3R3R)1(4bromobenzoyl)3(thiophene2carbonyl)spiro(1Hindole3233adihydro1Hpyrrolo(12a)quinoline)2one
Brc1ccc(cc1)C(=O)(C@@H)1N2c3ccccc3C=CC2(C@@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1cccs1
C1=CC=C2C(=C1)C=CC3N2C(C4(C3C(=O)C5=CC=CS5)C6=CC=CC=C6NC4=O)C(=O)C7=CC=C(C=C7)Br
InChI=1SC31H21BrN2O3Sc3220141119(121520)27(35)2931(21723822(21)3330(31)37)26(28(36)25105173825)24161318614923(18)34(24)29h117242629H(H3337)t24?2629+31+m1s1
MFCD18241717
ZINC000101068848
ZINC000101068851
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