Vitas-M small molecule compound

2-[(2E)-2-{[1-(2,6-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}hydrazinyl]-1,3-benzothiazole

Catalog ID
STK385961
SMILES Cc1cccc(c1n1c(C)cc(c1C)/C=N/Nc1nc2c(s1)cccc2)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 C22H22N4S MW 374.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4S/c1-14-8-7-9-15(2)21(14)26-16(3)12-18(17(26)4)13-23-25-22-24-19-10-5-6-11-20(19)27-22/h5-13H,1-4H3,(H,24,25)/b23-13+
InChIKey
MTYGTMPCVPVLAY-YDZHTSKRSA-N
Synonyms
676154-58-8
((1E)2(1(26DIMETHYLPHENYL)25DIMETHYLPYRROL3YL)1AZAVINYL)BENZOTHIAZOL2YLAMINE
(2Z)2((2E)((1(26DIMETHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)HYDRAZINYLIDENE)23DIHYDRO13BENZOTHIAZOLE
(E)2(2((1(26dimethylphenyl)25dimethyl1Hpyrrol3yl)methylene)hydrazinyl)benzo(d)thiazole
2((2E)2((1(26DIMETHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)HYDRAZINYL)13BENZOTHIAZOLE
676154588
CC1=C(C(=CC=C1)C)N2C(=CC(=C2C)C=NNC3=NC4=CC=CC=C4S3)C
Cc1cccc(c1n1c(C)cc(c1C)C=NNc1nc2c(s1)cccc2)C
InChI=1SC22H22N4Sc11487915(2)21(14)2616(3)1218(17(26)4)13232522241910561120(19)2722h513H14H3(H2425)b2313+
MFCD03274314
N((E)(1(26DIMETHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENEAMINO)13BENZOTHIAZOL2AMINE
ZINC16362425

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Available files

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