Vitas-M small molecule compound

(1'R,2'R)-1'-{[4-(2-methylpropyl)phenyl]carbonyl}-2'-phenyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione

Catalog ID
STK588676
SMILES CC(Cc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccccc1)C(=O)c1c(C2=O)cccc1)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 C37H31NO3 MW 537.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H31NO3/c1-23(2)22-24-16-18-27(19-17-24)34(39)33-32(26-11-4-3-5-12-26)37(35(40)28-13-7-8-14-29(28)36(37)41)31-21-20-25-10-6-9-15-30(25)38(31)33/h3-21,23,31-33H,22H2,1-2H3/t31?,32-,33+/m0/s1
InChIKey
RUALUVPOIQOUAP-ADIDXWPESA-N
Synonyms
1216946-06-3
(1R2R)1((4(2methylpropyl)phenyl)carbonyl)2phenyl12dihydro3aHspiro(indene23pyrrolo(12a)quinoline)13dione
(1R2R)1(4(2methylpropyl)benzoyl)2phenylspiro(23adihydro1Hpyrrolo(12a)quinoline32indene)13dione
(1R2R)1(4isobutylbenzoyl)2phenyl23adihydro1Hspiro(indene23pyrrolo(12a)quinoline)13dione
1216946063
CC(C)CC1=CC=C(C=C1)C(=O)C2C(C3(C4N2C5=CC=CC=C5C=C4)C(=O)C6=CC=CC=C6C3=O)C7=CC=CC=C7
CC(Cc1ccc(cc1)C(=O)(C@@H)1N2c3ccccc3C=CC2(C@@)2((C@H)1c1ccccc1)C(=O)c1c(C2=O)cccc1)C
CC(Cc1ccc(cc1)C(=O)(C@@H)1N2c3ccccc3C=CC2C2((C@H)1c1ccccc1)C(=O)c1c(C2=O)cccc1)C
InChI=1SC37H31NO3c123(2)2224161827(191724)34(39)3332(26114351226)37(35(40)2813781429(28)36(37)41)3121202510691530(25)38(31)33h321233133H22H212H3t31?3233+m0s1
ZINC000101269959
ZINC000101269962

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Available files

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