Vitas-M small molecule compound

N'-(2-{[4-benzyl-5-(quinolin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)thiophene-2-carbohydrazide

Catalog ID
STK774929
SMILES O=C(CSc1nnc(n1Cc1ccccc1)c1ccc2c(n1)cccc2)NNC(=O)c1cccs1

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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 C25H20N6O2S2 MW 500.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N6O2S2/c32-22(27-29-24(33)21-11-6-14-34-21)16-35-25-30-28-23(31(25)15-17-7-2-1-3-8-17)20-13-12-18-9-4-5-10-19(18)26-20/h1-14H,15-16H2,(H,27,32)(H,29,33)
InChIKey
OCJJKCWGDPKNDE-UHFFFAOYSA-N
Synonyms
672919-73-2
672919732
C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)NNC(=O)C3=CC=CS3)C4=NC5=CC=CC=C5C=C4
InChI=1SC25H20N6O2S2c3222(272924(33)21116143421)163525302823(31(25)15177213817)201312189451019(18)2620h114H1516H2(H2732)(H2933)
MFCD04061597
N(2((4benzyl5(quinolin2yl)4H124triazol3yl)sulfanyl)acetyl)thiophene2carbohydrazide
N(2((4benzyl5(quinolin2yl)4H124triazol3yl)thio)acetyl)thiophene2carbohydrazide
N(2((4BENZYL5QUINOLIN2YL124TRIAZOL3YL)SULFANYL)ACETYL)THIOPHENE2CARBOHYDRAZIDE
ZINC000001850502
ZINC01850502
ZINC1850502

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Available files

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