Vitas-M small molecule compound

N-[(2E)-4-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-thiazol-2(3H)-ylidene]methanesulfonamide

Catalog ID
STK644510
SMILES Clc1cccc(c1)N1CCN(CC1)C(=O)Cc1cs/c(=N/S(=O)(=O)C)/[nH]1

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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 C16H19ClN4O3S2 MW 414.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19ClN4O3S2/c1-26(23,24)19-16-18-13(11-25-16)10-15(22)21-7-5-20(6-8-21)14-4-2-3-12(17)9-14/h2-4,9,11H,5-8,10H2,1H3,(H,18,19)
InChIKey
ZJZLOXOXHUWUMW-UHFFFAOYSA-N
Synonyms
1010911-97-3
1010911973
Clc1cccc(c1)N1CCN(CC1)C(=O)Cc1csc(=NS(=O)(=O)C)(nH)1
CS(=O)(=O)NC1=NC(=CS1)CC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl
InChI=1SC16H19ClN4O3S2c126(2324)19161813(112516)1015(22)217520(6821)1442312(17)914h24911H5810H21H3(H1819)
MFCD18163640
N((2E)4(2(4(3chlorophenyl)piperazin1yl)2oxoethyl)13thiazol2(3H)ylidene)methanesulfonamide
ZINC000012324148
ZINC12324148

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Available files

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