Vitas-M small molecule compound

N-ethyl-2-({[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinecarbothioamide

Catalog ID
STK049932
SMILES CCNC(=S)NNC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C

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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 C20H22N6OS2 MW 426.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6OS2/c1-3-21-19(28)24-22-17(27)13-29-20-25-23-18(15-11-9-14(2)10-12-15)26(20)16-7-5-4-6-8-16/h4-12H,3,13H2,1-2H3,(H,22,27)(H2,21,24,28)
InChIKey
GLKMBCLOKZNKAL-UHFFFAOYSA-N
Synonyms
488731-93-7
1ETHYL3((2((5(4METHYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)THIOUREA
488731937
CCNC(=S)NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)C
CCNC(=S)NNC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C
InChI=1SC20H22N6OS2c132119(28)242217(27)132920252318(1511914(2)101215)26(20)167546816h412H313H212H3(H2227)(H2212428)
MFCD02024531
NETHYL2(((5(4METHYLPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINECARBOTHIOAMIDE
Nethyl2(2((4phenyl5(ptolyl)4H124triazol3yl)thio)acetyl)hydrazinecarbothioamide
STK049932
ZINC000001741329
ZINC01741329
ZINC1741329

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.