Vitas-M small molecule compound

2-(1,3-benzothiazol-2-yl)-4-chloro-5-[4-(3-chlorophenyl)piperazin-1-yl]pyridazin-3(2H)-one

Catalog ID
STK853088
SMILES Clc1cccc(c1)N1CCN(CC1)c1cnn(c(=O)c1Cl)c1nc2c(s1)cccc2

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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 C21H17Cl2N5OS MW 458.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Cl2N5OS/c22-14-4-3-5-15(12-14)26-8-10-27(11-9-26)17-13-24-28(20(29)19(17)23)21-25-16-6-1-2-7-18(16)30-21/h1-7,12-13H,8-11H2
InChIKey
NISXNVUUXRWKSV-UHFFFAOYSA-N
Synonyms
896821-81-1
2(13benzothiazol2yl)4chloro5(4(3chlorophenyl)piperazin1yl)pyridazin3(2H)one
2(13BENZOTHIAZOL2YL)4CHLORO5(4(3CHLOROPHENYL)PIPERAZIN1YL)PYRIDAZIN3ONE
2(benzo(d)thiazol2yl)4chloro5(4(3chlorophenyl)piperazin1yl)pyridazin3(2H)one
2BENZOTHIAZOL2YL4CHLORO5(4(3CHLOROPHENYL)PIPERAZIN1YL)2HPYRIDAZIN3ONE
896821811
C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=O)N(N=C3)C4=NC5=CC=CC=C5S4)Cl
InChI=1SC21H17Cl2N5OSc221443515(1214)2681027(11926)17132428(20(29)19(17)23)212516612718(16)3021h171213H811H2
MFCD06597601
ZINC000002210215
ZINC02210215
ZINC2210215

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Available files

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