Vitas-M small molecule compound

N-({4-[(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)carbonyl]cyclohexyl}methyl)-4-methylbenzenesulfonamide

Catalog ID
STL314979
SMILES Cc1ccc(cc1)S(=O)(=O)NCC1CCC(CC1)C(=O)N1CCC2(C(C1)CCCC2)O

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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 C24H36N2O4S MW 448.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H36N2O4S/c1-18-5-11-22(12-6-18)31(29,30)25-16-19-7-9-20(10-8-19)23(27)26-15-14-24(28)13-3-2-4-21(24)17-26/h5-6,11-12,19-21,25,28H,2-4,7-10,13-17H2,1H3
InChIKey
GNGOGENXRXJQPQ-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)N3CCC4(CCCCC4C3)O
Cc1ccc(cc1)S(=O)(=O)NC(C@@H)1CC(C@H)(CC1)C(=O)N1CC(C@@)2((C@H)(C1)CCCC2)O
InChI=1SC24H36N2O4Sc11851122(12618)31(2930)2516197920(10819)23(27)26151424(28)1332421(24)1726h56111219212528H247101317H21H3
MFCD28026991
N(((1S4r)4((4aS8aS)4ahydroxydecahydroisoquinoline2carbonyl)cyclohexyl)methyl)4methylbenzenesulfonamide
N((4((4ahydroxyoctahydroisoquinolin2(1H)yl)carbonyl)cyclohexyl)methyl)4methylbenzenesulfonamide
N((4(4ahydroxy13456788aoctahydroisoquinoline2carbonyl)cyclohexyl)methyl)4methylbenzenesulfonamide
ZINC000079475151
ZINC000095476729

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Available files

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