Vitas-M small molecule compound

(3aR,4S,9aR,9bS)-2-(4-acetylphenyl)-4-[(4-chlorophenyl)carbonyl]-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione

Catalog ID
STK547876
SMILES Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)C(=O)C)C(=O)c1ccccc1

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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 C32H23ClN2O5 MW 551.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23ClN2O5/c1-18(36)19-9-13-24(14-10-19)35-31(39)26-25-17-22(29(37)20-5-3-2-4-6-20)15-16-34(25)28(27(26)32(35)40)30(38)21-7-11-23(33)12-8-21/h2-17,25-28H,1H3/t25-,26-,27-,28+/m1/s1
InChIKey
CDSGCMRIHZXVSV-HPQIJTKRSA-N
Synonyms

(3aR4S9aR9bS)2(4acetylphenyl)4((4chlorophenyl)carbonyl)8(phenylcarbonyl)3a49a9btetrahydro1Hpyrrolo(34a)indolizine13(2H)dione
(3aR4S9aR9bS)2(4acetylphenyl)8benzoyl4(4chlorobenzoyl)3a49a9btetrahydro1Hpyrrolo(34a)indolizine13(2H)dione
(3AR4S9AR9BS)2(4ACETYLPHENYL)8BENZOYL4(4CHLOROBENZOYL)3A49A9BTETRAHYDROPYRROLO(34A)INDOLIZINE13DIONE
CC(=O)C1=CC=C(C=C1)N2C(=O)C3C4C=C(C=CN4C(C3C2=O)C(=O)C5=CC=C(C=C5)Cl)C(=O)C6=CC=CC=C6
Clc1ccc(cc1)C(=O)(C@H)1N2C=CC(=C(C@@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc(cc1)C(=O)C)C(=O)c1ccccc1
InChI=1SC32H23ClN2O5c118(36)1991324(141019)3531(39)26251722(29(37)205324620)151634(25)28(27(26)32(35)40)30(38)2171123(33)12821h2172528H1H3t25262728+m1s1
MFCD18242379
ZINC000001275301
ZINC1275301

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Available files

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