Vitas-M small molecule compound

(2E)-N-(5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylprop-2-enamide

Catalog ID
STK095632
SMILES O=C(Nc1nnc(s1)SCC(=O)N1CCN(CC1)c1ccccc1)/C=C/c1ccccc1

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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 C23H23N5O2S2 MW 465.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O2S2/c29-20(12-11-18-7-3-1-4-8-18)24-22-25-26-23(32-22)31-17-21(30)28-15-13-27(14-16-28)19-9-5-2-6-10-19/h1-12H,13-17H2,(H,24,25,29)/b12-11+
InChIKey
WJHQQVVEBRWPPW-VAWYXSNFSA-N
Synonyms
535947-91-2
(2E)N((2Z)5((2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL)134THIADIAZOL2(3H)YLIDENE)3PHENYLPROP2ENAMIDE
(2E)N(5((2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL)134THIADIAZOL2YL)3PHENYLPROP2ENAMIDE
(E)N(5(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)SULFANYL134THIADIAZOL2YL)3PHENYLPROP2ENAMIDE
535947912
C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NN=C(S3)NC(=O)C=CC4=CC=CC=C4
InChI=1SC23H23N5O2S2c2920(1211187314818)2422252623(3222)311721(30)28151327(141628)1995261019h112H1317H2(H242529)b1211+
MFCD03356413
N(5((2oxo2(4phenylpiperazin1yl)ethyl)thio)134thiadiazol2yl)cinnamamide
O=C(Nc1nnc(s1)SCC(=O)N1CCN(CC1)c1ccccc1)C=Cc1ccccc1
STK095632
ZINC09477668
ZINC9477668

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Available files

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