Vitas-M small molecule compound
4-{3-[(4-benzylpiperazin-1-yl)sulfonyl]-4-methylphenyl}phthalazin-1(2H)-one
Catalog ID
STK878041
SMILES O=c1[nH]nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N1CCN(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 C26H26N4O3S MW 474.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O3S/c1-19-11-12-21(25-22-9-5-6-10-23(22)26(31)28-27-25)17-24(19)34(32,33)30-15-13-29(14-16-30)18-20-7-3-2-4-8-20/h2-12,17H,13-16,18H2,1H3,(H,28,31)InChIKey
KQJFZXLSZFKVDT-UHFFFAOYSA-NSynonyms
579444-32-94(3((4benzylpiperazin1yl)sulfonyl)4methylphenyl)phthalazin1(2H)one
4(3(4BENZYLPIPERAZIN1YL)SULFONYL4METHYLPHENYL)2HPHTHALAZIN1ONE
579444329
CC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)S(=O)(=O)N4CCN(CC4)CC5=CC=CC=C5
InChI=1SC26H26N4O3Sc119111221(25229561023(22)26(31)282725)1724(19)34(3233)30151329(141630)18207324820h21217H131618H21H3(H2831)
MFCD04032902
O=c1(nH)nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N1CCN(CC1)Cc1ccccc1)C
ZINC000020295085
ZINC20295085
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