Vitas-M small molecule compound
N-methyl-2-{4-[(4-{4-methyl-3-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}phthalazin-1-yl)amino]phenoxy}acetamide
Catalog ID
STK200890
SMILES CNC(=O)COc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N1CCN(CC1)C)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 C29H32N6O4S MW 560.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N6O4S/c1-20-8-9-21(18-26(20)40(37,38)35-16-14-34(3)15-17-35)28-24-6-4-5-7-25(24)29(33-32-28)31-22-10-12-23(13-11-22)39-19-27(36)30-2/h4-13,18H,14-17,19H2,1-3H3,(H,30,36)(H,31,33)InChIKey
XECONXBBCNRJOR-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)OCC(=O)NC)S(=O)(=O)N5CCN(CC5)C
InChI=1SC29H32N6O4Sc1208921(1826(20)40(3738)35161434(3)151735)2824645725(24)29(333228)3122101223(131122)391927(36)302h41318H141719H213H3(H3036)(H3133)
MFCD03292553
Nmethyl2(4((4(4methyl3((4methylpiperazin1yl)sulfonyl)phenyl)phthalazin1yl)amino)phenoxy)acetamide
NMETHYL2(4((4(4METHYL3(4METHYLPIPERAZIN1YL)SULFONYLPHENYL)PHTHALAZIN1YL)AMINO)PHENOXY)ACETAMIDE
ZINC000098000131
ZINC98000131
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