Vitas-M small molecule compound

4-({[(4-fluorophenyl)sulfonyl]amino}methyl)-N-(octahydro-2H-quinolizin-1-ylmethyl)cyclohexanecarboxamide

Catalog ID
STL466526
SMILES Fc1ccc(cc1)S(=O)(=O)NCC1CCC(CC1)C(=O)NCC1CCCN2C1CCCC2

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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 C24H36FN3O3S MW 465.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H36FN3O3S/c25-21-10-12-22(13-11-21)32(30,31)27-16-18-6-8-19(9-7-18)24(29)26-17-20-4-3-15-28-14-2-1-5-23(20)28/h10-13,18-20,23,27H,1-9,14-17H2,(H,26,29)
InChIKey
QRLCATAVPBJZDI-UHFFFAOYSA-N
Synonyms

(1r4S)4((4fluorophenylsulfonamido)methyl)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)cyclohexanecarboxamide
4((((4fluorophenyl)sulfonyl)amino)methyl)N(octahydro2Hquinolizin1ylmethyl)cyclohexanecarboxamide
C1CCN2CCCC(C2C1)CNC(=O)C3CCC(CC3)CNS(=O)(=O)C4=CC=C(C=C4)F
Fc1ccc(cc1)S(=O)(=O)NC(C@@H)1CC(C@H)(CC1)C(=O)NC(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC24H36FN3O3Sc2521101222(131121)32(3031)2716186819(9718)24(29)2617204315281421523(20)28h101318202327H191417H2(H2629)
MFCD31750902
N(23467899aoctahydro1Hquinolizin1ylmethyl)4(((4fluorophenyl)sulfonylamino)methyl)cyclohexane1carboxamide
ZINC000012296442
ZINC000094992889

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.