Vitas-M small molecule compound
2-({4-[(4-benzylpiperazin-1-yl)carbonothioyl]phenoxy}methyl)benzonitrile
Catalog ID
STL376433
SMILES N#Cc1ccccc1COc1ccc(cc1)C(=S)N1CCN(CC1)Cc1ccccc1
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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 C26H25N3OS MW 427.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3OS/c27-18-23-8-4-5-9-24(23)20-30-25-12-10-22(11-13-25)26(31)29-16-14-28(15-17-29)19-21-6-2-1-3-7-21/h1-13H,14-17,19-20H2InChIKey
AZWLBNZOQHPZRX-UHFFFAOYSA-NSynonyms
2((4((4benzylpiperazin1yl)carbonothioyl)phenoxy)methyl)benzonitrile
2((4(4BENZYLPIPERAZINE1CARBOTHIOYL)PHENOXY)METHYL)BENZONITRILE
C1CN(CCN1CC2=CC=CC=C2)C(=S)C3=CC=C(C=C3)OCC4=CC=CC=C4C#N
InChI=1SC26H25N3OSc271823845924(23)203025121022(111325)26(31)29161428(151729)19216213721h113H14171920H2
MFCD05998322
ZINC000019805100
ZINC19805100
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