Vitas-M small molecule compound

N-[2-methyl-5-({4-[(E)-2-phenylethenyl]piperazin-1-yl}carbonyl)phenyl]methanesulfonamide

Catalog ID
STL286754
SMILES O=C(c1ccc(c(c1)NS(=O)(=O)C)C)N1CCN(CC1)/C=C/c1ccccc1

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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 C21H25N3O3S MW 399.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O3S/c1-17-8-9-19(16-20(17)22-28(2,26)27)21(25)24-14-12-23(13-15-24)11-10-18-6-4-3-5-7-18/h3-11,16,22H,12-15H2,1-2H3/b11-10+
InChIKey
JRXQMQURUHRTSY-ZHACJKMWSA-N
Synonyms

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C=CC3=CC=CC=C3)NS(=O)(=O)C
InChI=1SC21H25N3O3Sc1178919(1620(17)2228(226)27)21(25)24141223(131524)1110186435718h3111622H1215H212H3b1110+
MFCD24847525
N(2methyl5((4((E)2phenylethenyl)piperazin1yl)carbonyl)phenyl)methanesulfonamide
N(2methyl5(4((E)2phenylethenyl)piperazine1carbonyl)phenyl)methanesulfonamide
O=C(c1ccc(c(c1)NS(=O)(=O)C)C)N1CCN(CC1)C=Cc1ccccc1
ZINC000095481731
ZINC95481731

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Available files

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