Vitas-M small molecule compound

(2E)-3-phenyl-N-({4-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]phenyl}carbamothioyl)prop-2-enamide

Catalog ID
STK252025
SMILES S=C(Nc1ccc(cc1)N1CCN(CC1)C(=O)c1cccs1)NC(=O)/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 C25H24N4O2S2 MW 476.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O2S2/c30-23(13-8-19-5-2-1-3-6-19)27-25(32)26-20-9-11-21(12-10-20)28-14-16-29(17-15-28)24(31)22-7-4-18-33-22/h1-13,18H,14-17H2,(H2,26,27,30,32)/b13-8+
InChIKey
XYJNDGMIUKRESD-MDWZMJQESA-N
Synonyms

(2E)3PHENYLN(((4(4(2THIENYLCARBONYL)PIPERAZINYL)PHENYL)AMINO)THIOXOMETHYL)PROP2ENAMIDE
(2E)3PHENYLN((4(4(THIOPHEN2YLCARBONYL)PIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
(E)3PHENYLN((4(4(THIOPHENE2CARBONYL)PIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
C1CN(CCN1C2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=CC=C3)C(=O)C4=CC=CS4
InChI=1SC25H24N4O2S2c3023(138195213619)2725(32)262091121(121020)28141629(171528)24(31)2274183322h11318H1417H2(H226273032)b138+
MFCD03649884
S=C(Nc1ccc(cc1)N1CCN(CC1)C(=O)c1cccs1)NC(=O)C=Cc1ccccc1
ZINC000001109121
ZINC01109121
ZINC1109121

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Available files

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