Vitas-M small molecule compound

2-chloro-N-(5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide

Catalog ID
STK080840
SMILES O=C(N1CCN(CC1)c1ccccc1)CSc1nnc(s1)NC(=O)c1ccccc1Cl

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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 C21H20ClN5O2S2 MW 474.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN5O2S2/c22-17-9-5-4-8-16(17)19(29)23-20-24-25-21(31-20)30-14-18(28)27-12-10-26(11-13-27)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,23,24,29)
InChIKey
LHASVRAGYUHWSQ-UHFFFAOYSA-N
Synonyms
535942-50-8
2CHLORON((2Z)5((2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL)134THIADIAZOL2(3H)YLIDENE)BENZAMIDE
2CHLORON(5((2OXO2(4PHENYL1PIPERAZINYL)ETHYL)SULFANYL)134THIADIAZOL2YL)BENZAMIDE
2CHLORON(5((2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL)134THIADIAZOL2YL)BENZAMIDE
2chloroN(5((2oxo2(4phenylpiperazin1yl)ethyl)thio)134thiadiazol2yl)benzamide
2CHLORON(5(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL134THIADIAZOL2YL)BENZAMIDE
C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NN=C(S3)NC(=O)C4=CC=CC=C4Cl
InChI=1SC21H20ClN5O2S2c2217954816(17)19(29)2320242521(3120)301418(28)27121026(111327)156213715h19H1014H2(H232429)
MFCD03356941
O=C(N1CCN(CC1)c1ccccc1)CSc1nnc(s1)NC(=O)c1ccccc1Cl
STK080840
ZINC000009090022
ZINC09090022
ZINC9090022

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Available files

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