Vitas-M small molecule compound

methyl {4-[(benzylcarbamothioyl)amino]phenyl}acetate

Catalog ID
STK142733
SMILES COC(=O)Cc1ccc(cc1)NC(=S)NCc1ccccc1

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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 C17H18N2O2S MW 314.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O2S/c1-21-16(20)11-13-7-9-15(10-8-13)19-17(22)18-12-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H2,18,19,22)
InChIKey
BOAIOQXMSFCCHT-UHFFFAOYSA-N
Synonyms
516457-05-9
516457059
COC(=O)CC1=CC=C(C=C1)NC(=S)NCC2=CC=CC=C2
InChI=1SC17H18N2O2Sc12116(20)11137915(10813)1917(22)1812145324614h210H1112H21H3(H2181922)
METHYL(4(((BENZYLAMINO)CARBONOTHIOYL)AMINO)PHENYL)ACETATE
METHYL(4((BENZYLCARBAMOTHIOYL)AMINO)PHENYL)ACETATE
METHYL2(4(((BENZYLAMINO)THIOXOMETHYL)AMINO)PHENYL)ACETATE
methyl2(4(3benzylthioureido)phenyl)acetate
METHYL2(4(BENZYLCARBAMOTHIOYLAMINO)PHENYL)ACETATE
MFCD03760025
ZINC000008682425
ZINC00537895
ZINC08682425
ZINC8682425

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Available files

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