Vitas-M small molecule compound

N-{[3-(butanoylamino)phenyl]carbamothioyl}-2-chlorobenzamide

Catalog ID
STK391260
SMILES CCCC(=O)Nc1cccc(c1)NC(=S)NC(=O)c1ccccc1Cl

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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 C18H18ClN3O2S MW 375.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O2S/c1-2-6-16(23)20-12-7-5-8-13(11-12)21-18(25)22-17(24)14-9-3-4-10-15(14)19/h3-5,7-11H,2,6H2,1H3,(H,20,23)(H2,21,22,24,25)
InChIKey
YAHIBAJBTDBVPZ-UHFFFAOYSA-N
Synonyms

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=CC=C2Cl
InChI=1SC18H18ClN3O2Sc12616(23)201275813(1112)2118(25)2217(24)149341015(14)19h35711H26H21H3(H2023)(H221222425)
MFCD02104737
N((3(butanoylamino)phenyl)carbamothioyl)2chlorobenzamide
N(3((((2CHLOROPHENYL)CARBONYLAMINO)THIOXOMETHYL)AMINO)PHENYL)BUTANAMIDE
ZINC000001218019
ZINC01218019
ZINC1218019

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Available files

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