(Z)-N-[3-[5-Fluoro-3-[(3-methoxy-1H-pyrrol-2-yl)methylene]-2-oxo-2,3-dihydro-1H-indol-4-yl]-prop-2-ynyl]-methanesulfonamide

HCID 15907935

Basic information

Standard SMILES
COc1cc[nH]c1/C=C1\C(=O)Nc2ccc(F)c(C#CCNS(C)(=O)=O)c21
InChIKey
SXIWDUUOYXQHPQ-BENRWUELSA-N
Molecular formula
C18H16FN3O4S
Average molar mass
389.4 g/mol
Monoisotopic mass
389.08455534

Names & identifiers

Preferred name
(Z)-N-[3-[5-Fluoro-3-[(3-methoxy-1H-pyrrol-2-yl)methylene]-2-oxo-2,3-dihydro-1H-indol-4-yl]-prop-2-ynyl]-methanesulfonamide
IUPAC
N-[3-[(3Z)-5-fluoro-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxo-1H-indol-4-yl]prop-2-ynyl]methanesulfonamide

Names & synonyms

SCHEMBL6965455SXIWDUUOYXQHPQ-BENRWUELSA-N(Z)-N-[3-[5-Fluoro-3-[(3-methoxy-1H-pyrrol-2-yl)methylene]-2-oxo-2,3-dihydro-1H-indol-4-yl]-prop-2-ynyl]-methanesulfonamide

Database identifiers

PubChem CID
15907935

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
109 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
27

Related reactions

3 records

Compound notes

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