Vitas-M small molecule compound
2-(4-chlorophenoxy)-N-[(Z)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(6-methoxy-1H-indol-3-yl)ethyl]amino}methylidene]acetamide
Catalog ID
STL447984
SMILES COc1ccc2c(c1)[nH]cc2CCN/C(=N/C(=O)COc1ccc(cc1)Cl)/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 C26H27ClN6O3 MW 506.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27ClN6O3/c1-16-12-17(2)31-26(30-16)33-25(32-24(34)15-36-20-6-4-19(27)5-7-20)28-11-10-18-14-29-23-13-21(35-3)8-9-22(18)23/h4-9,12-14,29H,10-11,15H2,1-3H3,(H2,28,30,31,32,33,34)InChIKey
KOWPSKIBQUKQSP-UHFFFAOYSA-NSynonyms
(E)2(4CHLOROPHENOXY)N((46DIMETHYLPYRIMIDIN2YLAMINO)(2(6METHOXY1HINDOL3YL)ETHYLAMINO)METHYLENE)ACETAMIDE
2(4chlorophenoxy)N((Z)((46dimethylpyrimidin2yl)amino)((2(6methoxy1Hindol3yl)ethyl)amino)methylidene)acetamide
2(4chlorophenoxy)N(N(46dimethylpyrimidin2yl)N(2(6methoxy1Hindol3yl)ethyl)carbamimidoyl)acetamide
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=CC(=C3)OC)NC(=O)COC4=CC=C(C=C4)Cl)C
COc1ccc2c(c1)(nH)cc2CCNC(=NC(=O)COc1ccc(cc1)Cl)Nc1nc(C)cc(n1)C
InChI=1SC26H27ClN6O3c1161217(2)3126(3016)3325(3224(34)1536206419(27)5720)281110181429231321(353)8922(18)23h49121429H101115H213H3(H2283031323334)
MFCD30712938
ZINC000008758474
ZINC8758474
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