Vitas-M small molecule compound

N-{(E)-[(3,5-dimethoxyphenyl)amino][(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-1-phenylmethanesulfonamide

Catalog ID
STK130688
SMILES COc1cc(cc(c1)OC)N/C(=N\S(=O)(=O)Cc1ccccc1)/Nc1nc(C)cc(n1)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 C22H25N5O4S MW 455.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O4S/c1-15-10-16(2)24-21(23-15)26-22(25-18-11-19(30-3)13-20(12-18)31-4)27-32(28,29)14-17-8-6-5-7-9-17/h5-13H,14H2,1-4H3,(H2,23,24,25,26,27)
InChIKey
BDKRFNXGJSZFDG-UHFFFAOYSA-N
Synonyms
650592-83-9
(1E)2((35DIMETHOXYPHENYL)AMINO)2((46DIMETHYLPYRIMIDIN2YL)AMINO)1(BENZYLSULFONYL)1AZAETHENE
(E)N(((35dimethoxyphenyl)amino)((46dimethylpyrimidin2yl)amino)methylene)1phenylmethanesulfonamide
2BENZYLSULFONYL1(35DIMETHOXYPHENYL)3(46DIMETHYLPYRIMIDIN2YL)GUANIDINE
CC1=CC(=NC(=N1)NC(=NS(=O)(=O)CC2=CC=CC=C2)NC3=CC(=CC(=C3)OC)OC)C
COc1cc(cc(c1)OC)NC(=NS(=O)(=O)Cc1ccccc1)Nc1nc(C)cc(n1)C
InChI=1SC22H25N5O4Sc1151016(2)2421(2315)2622(25181119(303)1320(1218)314)2732(2829)14178657917h513H14H214H3(H22324252627)
MFCD04014740
N(((35DIMETHOXYPHENYL)AMINO)((46DIMETHYLPYRIMIDIN2YL)AMINO)METHYLIDENE)1PHENYLMETHANESULFONAMIDE
N((E)((35DIMETHOXYPHENYL)AMINO)((46DIMETHYLPYRIMIDIN2YL)AMINO)METHYLIDENE)1PHENYLMETHANESULFONAMIDE
N(N(35DIMETHOXYPHENYL)N(46DIMETHYLPYRIMIDIN2YL)CARBAMIMIDOYL)1PHENYLMETHANESULFONAMIDE
ZINC18180016

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Available files

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