Vitas-M small molecule compound

(3S,3a'R,8a'S,8b'S)-5-chloro-2'-(3,4-dimethylphenyl)-7-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione

Catalog ID
STK573257
SMILES Clc1cc(C)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(c(c1)C)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 C25H24ClN3O3 MW 449.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3O3/c1-12-6-7-16(10-13(12)2)29-22(30)19-18-5-4-8-28(18)25(20(19)23(29)31)17-11-15(26)9-14(3)21(17)27-24(25)32/h6-7,9-11,18-20H,4-5,8H2,1-3H3,(H,27,32)/t18-,19+,20-,25+/m0/s1
InChIKey
CZMKBYDMJFYOHV-PBQROFAYSA-N
Synonyms
1013983-72-6
(3S3aR8aS8bS)5chloro2(34dimethylphenyl)7methyl3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3S3aR8aS8bS)5chloro2(34dimethylphenyl)7methyl6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
(3S3aR8aS8bS)5chloro2(34dimethylphenyl)7methylspiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
1013983726
CC1=C(C=C(C=C1)N2C(=O)C3C4CCCN4C5(C3C2=O)C6=CC(=CC(=C6NC5=O)C)Cl)C
Clc1cc(C)c2c(c1)(C@@)1(C(=O)N2)N2CCC(C@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc(c(c1)C)C
InChI=1SC25H24ClN3O3c1126716(1013(12)2)2922(30)191854828(18)25(20(19)23(29)31)171115(26)914(3)21(17)2724(25)32h679111820H458H213H3(H2732)t1819+2025+m0s1
MFCD18245468
ZINC000035851936
ZINC35851936

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Available files

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