Vitas-M small molecule compound

N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-4-tert-butylbenzamide

Catalog ID
STK231663
SMILES Clc1ccc(c(c1)c1nc2c(s1)cccc2)NC(=O)c1ccc(cc1)C(C)(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 C24H21ClN2OS MW 420.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN2OS/c1-24(2,3)16-10-8-15(9-11-16)22(28)26-19-13-12-17(25)14-18(19)23-27-20-6-4-5-7-21(20)29-23/h4-14H,1-3H3,(H,26,28)
InChIKey
HVNQNFZIMVJANL-UHFFFAOYSA-N
Synonyms

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)Cl)C3=NC4=CC=CC=C4S3
InChI=1SC24H21ClN2OSc124(23)1610815(91116)22(28)2619131217(25)1418(19)232720645721(20)2923h414H13H3(H2628)
MFCD05661616
N(2(13benzothiazol2yl)4chlorophenyl)4tertbutylbenzamide
N(2BENZOTHIAZOL2YL4CHLOROPHENYL)(4(TERTBUTYL)PHENYL)CARBOXAMIDE
ZINC000004554938
ZINC04554938
ZINC4554938

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Available files

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