Vitas-M small molecule compound

1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea

Catalog ID
STL047362
SMILES O=C(/N=c\1/[nH]nc(s1)Cc1ccc(c(c1)Cl)Cl)Nc1ccccc1

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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 C16H12Cl2N4OS MW 379.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12Cl2N4OS/c17-12-7-6-10(8-13(12)18)9-14-21-22-16(24-14)20-15(23)19-11-4-2-1-3-5-11/h1-8H,9H2,(H2,19,20,22,23)
InChIKey
YGXBRPAAOLZNKN-UHFFFAOYSA-N
Synonyms
424801-62-7
1((2Z)5(34dichlorobenzyl)134thiadiazol2(3H)ylidene)3phenylurea
1(5((34DICHLOROPHENYL)METHYL)134THIADIAZOL2YL)3PHENYLUREA
1(5(34DICHLOROBENZYL)134THIADIAZOL2YL)3PHENYLUREA
424801627
C1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CC3=CC(=C(C=C3)Cl)Cl
InChI=1SC16H12Cl2N4OSc17127610(813(12)18)914212216(2414)2015(23)19114213511h18H9H2(H219202223)
MFCD03797577
O=C(N=c1(nH)nc(s1)Cc1ccc(c(c1)Cl)Cl)Nc1ccccc1
ZINC000001298865
ZINC01298865
ZINC1298865

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Available files

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