Vitas-M small molecule compound
(2E)-3-[4-methoxy-3-(piperidin-1-ylsulfonyl)phenyl]-1-(4-methylpiperazin-1-yl)prop-2-en-1-one
Catalog ID
STK976808
SMILES COc1ccc(cc1S(=O)(=O)N1CCCCC1)/C=C/C(=O)N1CCN(CC1)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 C20H29N3O4S MW 407.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N3O4S/c1-21-12-14-22(15-13-21)20(24)9-7-17-6-8-18(27-2)19(16-17)28(25,26)23-10-4-3-5-11-23/h6-9,16H,3-5,10-15H2,1-2H3/b9-7+InChIKey
OLHYXDCAOPBMJY-VQHVLOKHSA-NSynonyms
(2E)3(4methoxy3(piperidin1ylsulfonyl)phenyl)1(4methylpiperazin1yl)prop2en1one
(E)3(4methoxy3(piperidin1ylsulfonyl)phenyl)1(4methylpiperazin1yl)prop2en1one
(E)3(4methoxy3piperidin1ylsulfonylphenyl)1(4methylpiperazin1yl)prop2en1one
1(3(4METHOXY3(1PIPERIDINYLSULFONYL)PHENYL)ACRYLOYL)4METHYLPIPERAZINE
CN1CCN(CC1)C(=O)C=CC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3
COc1ccc(cc1S(=O)(=O)N1CCCCC1)C=CC(=O)N1CCN(CC1)C
InChI=1SC20H29N3O4Sc121121422(151321)20(24)97176818(272)19(1617)28(2526)23104351123h6916H351015H212H3b97+
MFCD01795560
ZINC000055416886
ZINC55416886
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