Vitas-M small molecule compound
2-[4-(furan-2-ylmethyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyrazine
Catalog ID
STL228849
SMILES c1ccc(cc1)/C=C/CSc1nnc(n1Cc1ccco1)c1nccnc1
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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 C20H17N5OS MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N5OS/c1-2-6-16(7-3-1)8-5-13-27-20-24-23-19(18-14-21-10-11-22-18)25(20)15-17-9-4-12-26-17/h1-12,14H,13,15H2/b8-5+InChIKey
XTOQABGERXWUIT-VMPITWQZSA-NSynonyms
1164554-82-8(E)2(5(cinnamylthio)4(furan2ylmethyl)4H124triazol3yl)pyrazine
1164554828
2(4(2FURYLMETHYL)5((3PHENYL2PROPEN1YL)THIO)4H124TRIAZOL3YL)PYRAZINE
2(4(furan2ylmethyl)5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazol3yl)pyrazine
2(4(FURAN2YLMETHYL)5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOL3YL)PYRAZINE
C1=CC=C(C=C1)C=CCSC2=NN=C(N2CC3=CC=CO3)C4=NC=CN=C4
c1ccc(cc1)C=CCSc1nnc(n1Cc1ccco1)c1nccnc1
InChI=1SC20H17N5OSc12616(731)85132720242319(18142110112218)25(20)151794122617h11214H1315H2b85+
MFCD04014526
ZINC000002356281
ZINC02356281
ZINC2356281
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