Vitas-M small molecule compound

5-(2-chlorophenyl)-4-{[(1E,2E)-3-phenylprop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK583129
SMILES Clc1ccccc1c1n[nH]c(=S)n1/N=C/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 C17H13ClN4S MW 340.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN4S/c18-15-11-5-4-10-14(15)16-20-21-17(23)22(16)19-12-6-9-13-7-2-1-3-8-13/h1-12H,(H,21,23)/b9-6+,19-12+
InChIKey
PGSJUNMVZWHMJQ-YKIVCEQRSA-N
Synonyms
613248-61-6
3(2chlorophenyl)4((E)((E)3phenylprop2enylidene)amino)1H124triazole5thione
4((1E3E)4PHENYL1AZABUTA13DIENYL)5(2CHLOROPHENYL)124TRIAZOLE3THIOL
5(2chlorophenyl)4(((1E2E)3phenylprop2en1ylidene)amino)24dihydro3H124triazole3thione
613248616
C1=CC=C(C=C1)C=CC=NN2C(=NNC2=S)C3=CC=CC=C3Cl
Clc1ccccc1c1n(nH)c(=S)n1N=CC=Cc1ccccc1
InChI=1SC17H13ClN4Sc181511541014(15)16202117(23)22(16)191269137213813h112H(H2123)b96+1912+
MFCD07198908
ZINC000006192674
ZINC33404902

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Available files

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