Vitas-M small molecule compound
4-{3-[(4-benzylpiperidin-1-yl)sulfonyl]-4-methylphenyl}-2-methylphthalazin-1(2H)-one
Catalog ID
STK878034
SMILES O=c1n(C)nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N1CCC(CC1)Cc1ccccc1)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 C28H29N3O3S MW 487.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O3S/c1-20-12-13-23(27-24-10-6-7-11-25(24)28(32)30(2)29-27)19-26(20)35(33,34)31-16-14-22(15-17-31)18-21-8-4-3-5-9-21/h3-13,19,22H,14-18H2,1-2H3InChIKey
VZKIRHWAZUHTKY-UHFFFAOYSA-NSynonyms
799258-44-94(3((4benzylpiperidin1yl)sulfonyl)4methylphenyl)2methylphthalazin1(2H)one
4(3(4BENZYLPIPERIDIN1YL)SULFONYL4METHYLPHENYL)2METHYLPHTHALAZIN1ONE
799258449
CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C)S(=O)(=O)N4CCC(CC4)CC5=CC=CC=C5
InChI=1SC28H29N3O3Sc120121323(272410671125(24)28(32)30(2)2927)1926(20)35(3334)31161422(151731)18218435921h3131922H1418H212H3
MFCD04007757
ZINC000000802300
ZINC00802300
ZINC802300
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