Vitas-M small molecule compound

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

Catalog ID
STL222005
SMILES COc1ccc(c2c1N[C@@H](c1ccc(cc1)Br)[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 C20H20BrNO MW 370.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrNO/c1-12-6-11-17(23-2)20-18(12)15-4-3-5-16(15)19(22-20)13-7-9-14(21)10-8-13/h3-4,6-11,15-16,19,22H,5H2,1-2H3/t15-,16+,19+/m1/s1
InChIKey
HTSZQRISIGVTKT-GJYPPUQNSA-N
Synonyms

(3aS4R9bR)4(4bromophenyl)6methoxy9methyl3a459btetrahydro3Hcyclopenta(c)quinoline
CC1=C2C3C=CCC3C(NC2=C(C=C1)OC)C4=CC=C(C=C4)Br
COc1ccc(c2c1N(C@@H)(c1ccc(cc1)Br)(C@@H)1(C@H)2C=CC1)C
InChI=1SC20H20BrNOc11261117(232)2018(12)1543516(15)19(2220)137914(21)10813h3461115161922H5H212H3t1516+19+m1s1
MFCD24857550
ZINC000004757807
ZINC04757807
ZINC4757807

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Available files

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