Vitas-M small molecule compound

N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide

Catalog ID
STK073271
SMILES CCCCCC(NC(=O)CCC(=O)NCc1cccs1)C

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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 C16H26N2O2S MW 310.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H26N2O2S/c1-3-4-5-7-13(2)18-16(20)10-9-15(19)17-12-14-8-6-11-21-14/h6,8,11,13H,3-5,7,9-10,12H2,1-2H3,(H,17,19)(H,18,20)
InChIKey
CPIDTSNQRWJNDG-UHFFFAOYSA-N
Synonyms
733799-77-4
733799774
CCCCCC(C)NC(=O)CCC(=O)NCC1=CC=CS1
CCCCCC(NC(=O)CCC(=O)NCc1cccs1)C
InChI=1SC16H26N2O2Sc1345713(2)1816(20)10915(19)17121486112114h681113H35791012H212H3(H1719)(H1820)
MFCD08679635
N(HEPTAN2YL)N(THIOPHEN2YLMETHYL)BUTANEDIAMIDE
NHEPTAN2YLN(THIOPHEN2YLMETHYL)BUTANEDIAMIDE
STK073271
ZINC000004599961
ZINC000004599962

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Available files

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