Vitas-M small molecule compound

(3aS,4R,9bR)-6-chloro-4-[4-(thietan-3-yloxy)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline

Catalog ID
STL222002
SMILES Clc1cccc2c1N[C@@H](c1ccc(cc1)OC1CSC1)[C@@H]1[C@H]2C=CC1

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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 C21H20ClNOS MW 369.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClNOS/c22-19-6-2-5-18-16-3-1-4-17(16)20(23-21(18)19)13-7-9-14(10-8-13)24-15-11-25-12-15/h1-3,5-10,15-17,20,23H,4,11-12H2/t16-,17+,20+/m1/s1
InChIKey
PMSJPCTYTIHYLR-UWVAXJGDSA-N
Synonyms

(3aS4R9bR)6chloro4(4(thietan3yloxy)phenyl)3a459btetrahydro3Hcyclopenta(c)quinoline
C1C=CC2C1C(NC3=C2C=CC=C3Cl)C4=CC=C(C=C4)OC5CSC5
Clc1cccc2c1N(C@@H)(c1ccc(cc1)OC1CSC1)(C@@H)1(C@H)2C=CC1
InChI=1SC21H20ClNOSc2219625181631417(16)20(2321(18)19)137914(10813)241511251215h1351015172023H41112H2t1617+20+m1s1
MFCD24857548
ZINC000004501461
ZINC04501461
ZINC4501461

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Available files

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