Vitas-M small molecule compound

N-{[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamothioyl}-4-ethoxybenzamide

Catalog ID
STK173004
SMILES CCOc1ccc(cc1)C(=O)NC(=S)Nc1cccc(c1C)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 C24H21N3O2S2 MW 447.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O2S2/c1-3-29-17-13-11-16(12-14-17)22(28)27-24(30)26-19-9-6-7-18(15(19)2)23-25-20-8-4-5-10-21(20)31-23/h4-14H,3H2,1-2H3,(H2,26,27,28,30)
InChIKey
OUCHIOCUTCUFKA-UHFFFAOYSA-N
Synonyms

CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2C)C3=NC4=CC=CC=C4S3
InChI=1SC24H21N3O2S2c132917131116(121417)22(28)2724(30)261996718(15(19)2)2325208451021(20)3123h414H3H212H3(H226272830)
MFCD02631810
N((3(13BENZOTHIAZOL2YL)2METHYLPHENYL)CARBAMOTHIOYL)4ETHOXYBENZAMIDE
ZINC000002983896
ZINC02983896
ZINC2983896

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Available files

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