Vitas-M small molecule compound
1-[(2Z)-5-(cyclohex-1-en-1-ylmethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3,4-dichlorophenyl)urea
Catalog ID
STK600458
SMILES O=C(/N=c\1/[nH]nc(s1)CC1=CCCCC1)Nc1ccc(c(c1)Cl)Cl
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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 C16H16Cl2N4OS MW 383.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16Cl2N4OS/c17-12-7-6-11(9-13(12)18)19-15(23)20-16-22-21-14(24-16)8-10-4-2-1-3-5-10/h4,6-7,9H,1-3,5,8H2,(H2,19,20,22,23)InChIKey
VPWXRXYKNADFAY-UHFFFAOYSA-NSynonyms
488852-39-71((2Z)5(cyclohex1en1ylmethyl)134thiadiazol2(3H)ylidene)3(34dichlorophenyl)urea
1(5(CYCLOHEXEN1YLMETHYL)134THIADIAZOL2YL)3(34DICHLOROPHENYL)UREA
1(5CYCLOHEX1ENYLMETHYL(134)THIADIAZOL2YL)3(34DICHLOROPHENYL)UREA
488852397
C1CCC(=CC1)CC2=NN=C(S2)NC(=O)NC3=CC(=C(C=C3)Cl)Cl
InChI=1SC16H16Cl2N4OSc17127611(913(12)18)1915(23)2016222114(2416)8104213510h4679H1358H2(H219202223)
MFCD08734031
O=C(N=c1(nH)nc(s1)CC1=CCCCC1)Nc1ccc(c(c1)Cl)Cl
ZINC000008767496
ZINC08767496
ZINC8767496
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