Vitas-M small molecule compound

(3aS,4R,9bR)-4-(2,4-dichlorophenyl)-6-methoxy-9-methyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline

Catalog ID
STK709674
SMILES COc1ccc(c2c1N[C@@H](c1ccc(cc1Cl)Cl)[C@@H]1[C@H]2C=CC1)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 C20H19Cl2NO MW 360.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19Cl2NO/c1-11-6-9-17(24-2)20-18(11)13-4-3-5-14(13)19(23-20)15-8-7-12(21)10-16(15)22/h3-4,6-10,13-14,19,23H,5H2,1-2H3/t13-,14+,19-/m1/s1
InChIKey
QKSSIIHHEJHJIV-BIENJYKASA-N
Synonyms

(3aS4R9bR)4(24dichlorophenyl)6methoxy9methyl3a459btetrahydro3Hcyclopenta(c)quinoline
CC1=C2C3C=CCC3C(NC2=C(C=C1)OC)C4=C(C=C(C=C4)Cl)Cl
COc1ccc(c2c1N(C@@H)(c1ccc(cc1Cl)Cl)(C@@H)1(C@H)2C=CC1)C
InChI=1SC20H19Cl2NOc1116917(242)2018(11)1343514(13)19(2320)158712(21)1016(15)22h3461013141923H5H212H3t1314+19m1s1
MFCD09992424
ZINC000003629175
ZINC03629175
ZINC3629175

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Available files

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