Vitas-M small molecule compound

N-[(1Z)-3-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino}-3-oxo-1-phenylprop-1-en-2-yl]benzamide

Catalog ID
STK760719
SMILES Cc1ccc2c(c1)sc(n2)c1ccc(cc1)NC(=O)/C(=C/c1ccccc1)/NC(=O)c1ccccc1

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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 C30H23N3O2S MW 489.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23N3O2S/c1-20-12-17-25-27(18-20)36-30(33-25)23-13-15-24(16-14-23)31-29(35)26(19-21-8-4-2-5-9-21)32-28(34)22-10-6-3-7-11-22/h2-19H,1H3,(H,31,35)(H,32,34)/b26-19-
InChIKey
WIBWACVAKIEMJA-XHPQRKPJSA-N
Synonyms

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C(=CC4=CC=CC=C4)NC(=O)C5=CC=CC=C5
Cc1ccc2c(c1)sc(n2)c1ccc(cc1)NC(=O)C(=Cc1ccccc1)NC(=O)c1ccccc1
InChI=1SC30H23N3O2Sc12012172527(1820)3630(3325)23131524(161423)3129(35)26(19218425921)3228(34)22106371122h219H1H3(H3135)(H3234)b2619
MFCD01819453
N((1Z)3((4(6methyl13benzothiazol2yl)phenyl)amino)3oxo1phenylprop1en2yl)benzamide
N((Z)3(4(6METHYL13BENZOTHIAZOL2YL)ANILINO)3OXO1PHENYLPROP1EN2YL)BENZAMIDE
ZINC000003669405
ZINC03669405
ZINC3669405

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Available files

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