Vitas-M small molecule compound

N,N-dimethyl-4-(4-nitro-3-{[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]amino}phenyl)piperazine-1-sulfonamide

Catalog ID
STK149014
SMILES CC(C12CC3CC(C2)CC(C1)C3)Nc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)N(C)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 C24H37N5O4S MW 491.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H37N5O4S/c1-17(24-14-18-10-19(15-24)12-20(11-18)16-24)25-22-13-21(4-5-23(22)29(30)31)27-6-8-28(9-7-27)34(32,33)26(2)3/h4-5,13,17-20,25H,6-12,14-16H2,1-3H3
InChIKey
IZPXQWUDGFFQRT-UHFFFAOYSA-N
Synonyms

4(3(1(1ADAMANTYL)ETHYLAMINO)4NITROPHENYL)NNDIMETHYLPIPERAZINE1SULFONAMIDE
CC(C12CC3CC(C1)CC(C3)C2)NC4=C(C=CC(=C4)N5CCN(CC5)S(=O)(=O)N(C)C)(N+)(=O)(O)
CC(C12CC3CC(C2)CC(C1)C3)Nc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)N(C)C
InChI=1SC24H37N5O4Sc117(2414181019(1524)1220(1118)1624)25221321(4523(22)29(30)31)276828(9727)34(3233)26(2)3h4513172025H6121416H213H3
MFCD03306460
NNdimethyl4(4nitro3((1(tricyclo(3311~37~)dec1yl)ethyl)amino)phenyl)piperazine1sulfonamide
ZINC000009720332
ZINC000009720333

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Available files

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