Vitas-M small molecule compound

propyl 4-[({2-[(4-chlorophenyl)acetyl]hydrazinyl}carbonothioyl)amino]-4-oxobutanoate

Catalog ID
STL064769
SMILES CCCOC(=O)CCC(=O)NC(=S)NNC(=O)Cc1ccc(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 C16H20ClN3O4S MW 385.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20ClN3O4S/c1-2-9-24-15(23)8-7-13(21)18-16(25)20-19-14(22)10-11-3-5-12(17)6-4-11/h3-6H,2,7-10H2,1H3,(H,19,22)(H2,18,20,21,25)
InChIKey
BVPJDXBAIRUWKH-UHFFFAOYSA-N
Synonyms

CCCOC(=O)CCC(=O)NC(=S)NNC(=O)CC1=CC=C(C=C1)Cl
InChI=1SC16H20ClN3O4Sc1292415(23)8713(21)1816(25)201914(22)10113512(17)6411h36H2710H21H3(H1922)(H218202125)
MFCD05875963
propyl4(((2((4chlorophenyl)acetyl)hydrazinyl)carbonothioyl)amino)4oxobutanoate
PROPYL4(((2(4CHLOROPHENYL)ACETYL)AMINO)CARBAMOTHIOYLAMINO)4OXOBUTANOATE
ZINC000012137499
ZINC12137499

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Available files

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