Vitas-M small molecule compound
4-{(E)-[2-(4-benzylpiperazin-1-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}phenyl benzenesulfonate
Catalog ID
STK558617
SMILES O=C1N=C(S/C/1=C/c1ccc(cc1)OS(=O)(=O)c1ccccc1)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 C27H25N3O4S2 MW 519.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O4S2/c31-26-25(19-21-11-13-23(14-12-21)34-36(32,33)24-9-5-2-6-10-24)35-27(28-26)30-17-15-29(16-18-30)20-22-7-3-1-4-8-22/h1-14,19H,15-18,20H2/b25-19+InChIKey
KDTRLOYYBSGZHG-NCELDCMTSA-NSynonyms
586991-60-8(4((E)(2(4BENZYLPIPERAZIN1YL)4OXO13THIAZOL5YLIDENE)METHYL)PHENYL)BENZENESULFONATE
(E)4((2(4benzylpiperazin1yl)4oxothiazol5(4H)ylidene)methyl)phenylbenzenesulfonate
4((E)(2(4benzylpiperazin1yl)4oxo13thiazol5(4H)ylidene)methyl)phenylbenzenesulfonate
586991608
C1CN(CCN1CC2=CC=CC=C2)C3=NC(=O)C(=CC4=CC=C(C=C4)OS(=O)(=O)C5=CC=CC=C5)S3
InChI=1SC27H25N3O4S2c312625(1921111323(141221)3436(3233)2495261024)3527(2826)30171529(161830)20227314822h11419H151820H2b2519+
MFCD04033428
O=C1N=C(SC1=Cc1ccc(cc1)OS(=O)(=O)c1ccccc1)N1CCN(CC1)Cc1ccccc1
ZINC000013757827
ZINC13757827
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