Vitas-M small molecule compound

methyl [(2E)-5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]carbamate

Catalog ID
STL041365
SMILES COC(=O)/N=c/1\[nH]nc(s1)COc1ccc(cc1)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 C11H10ClN3O3S MW 299.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H10ClN3O3S/c1-17-11(16)13-10-15-14-9(19-10)6-18-8-4-2-7(12)3-5-8/h2-5H,6H2,1H3,(H,13,15,16)
InChIKey
IBANLHDXNYRDPG-UHFFFAOYSA-N
Synonyms
714917-77-8
714917778
COC(=O)N=c1(nH)nc(s1)COc1ccc(cc1)Cl
COC(=O)NC1=NN=C(S1)COC2=CC=C(C=C2)Cl
InChI=1SC11H10ClN3O3Sc11711(16)131015149(1910)6188427(12)358h25H6H21H3(H131516)
methyl((2E)5((4chlorophenoxy)methyl)134thiadiazol2(3H)ylidene)carbamate
METHYLN(5((4CHLOROPHENOXY)METHYL)134THIADIAZOL2YL)CARBAMATE
MFCD05732680
ZINC000005554984
ZINC05554984
ZINC5554984

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Available files

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