Vitas-M small molecule compound

1'-[(4-chlorophenyl)carbonyl]-2'-(2-ethoxyphenyl)-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione

Catalog ID
STK567495
SMILES CCOc1ccccc1C1C(C(=O)c2ccc(cc2)Cl)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)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 C36H28ClNO4 MW 574.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H28ClNO4/c1-3-42-29-11-7-6-10-27(29)31-32(33(39)22-13-16-24(37)17-14-22)38-28-18-12-21(2)20-23(28)15-19-30(38)36(31)34(40)25-8-4-5-9-26(25)35(36)41/h4-20,30-32H,3H2,1-2H3
InChIKey
NYEVIRDTHGCRLA-UHFFFAOYSA-N
Synonyms

(1R2R)1(4chlorobenzoyl)2(2ethoxyphenyl)7methyl23adihydro1Hspiro(indene23pyrrolo(12a)quinoline)13dione
1((4chlorophenyl)carbonyl)2(2ethoxyphenyl)7methyl12dihydro3aHspiro(indene23pyrrolo(12a)quinoline)13dione
1(4CHLOROBENZOYL)2(2ETHOXYPHENYL)7METHYLSPIRO(23ADIHYDRO1HPYRROLO(12A)QUINOLINE32INDENE)13DIONE
CCOC1=CC=CC=C1C2C(N3C(C24C(=O)C5=CC=CC=C5C4=O)C=CC6=C3C=CC(=C6)C)C(=O)C7=CC=C(C=C7)Cl
CCOc1ccccc1(C@H)1(C@H)(C(=O)c2ccc(cc2)Cl)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C
InChI=1SC36H28ClNO4c13422911761027(29)3132(33(39)22131624(37)171422)3828181221(2)2023(28)151930(38)36(31)34(40)25845926(25)35(36)41h4203032H3H212H3
MFCD05737290
ZINC000002591637
ZINC000229949599

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.