AC1NRB4O structure

AC1NRB4O

6-(3,5-dimethylpiperidin-1-yl)-1,4-dimethyl-2-oxo-5-[(4-oxo-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile

Also Known As: 6-(3,5-Dimethylpiperidin-1-yl)-1,4-dimethyl-2-oxo-5-{[4-oxo-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-1,2-dihydropyridine-3-carbonitrile|6-(3,5-dimethylpiperidin-1-yl)-1,4-dimethyl-2-oxo-5-[(4-oxo-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile

CAS: 7063-32-3
Molecular Formula C22H28N4O2S2
Molecular Weight 444.16537 g/mol
LogP 3.6573
Topological Polar Surface Area 69.34 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 3
Exact Mass 444.16537
Monoisotopic Mass 444.16537
Heavy Atoms 30
Complexity 1025.0438

Chemical Identifiers

CAS Number 7063-32-3
SMILES CC1CC(CN(C1)C2=C(C(=C(C(=O)N2C)C#N)C)C=C3C(=O)N(C(=S)S3)C(C)C)C

Product Overview

AC1NRB4O (CAS 7063-32-3), with molecular formula C22H28N4O2S2 and molecular weight 444.16537 g/mol. IUPAC: 6-(3,5-dimethylpiperidin-1-yl)-1,4-dimethyl-2-oxo-5-[(4-oxo-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile.

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