N-(6-Bromo-5',6'-dihydro-4'H-spiro[chromene-2,3'-pyran]-4(3H)-ylidene)-2-methylpropane-2-sulfinamide

HCID 67979337

Basic information

Standard SMILES
CC(C)(C)S(=O)N=C1CC2(CCCOC2)Oc2ccc(Br)cc21
InChIKey
JFIQOJPCUVCJLX-UHFFFAOYSA-N
Molecular formula
C17H22BrNO3S
Average molar mass
400.3 g/mol

Names & identifiers

Preferred name
N-(6-Bromo-5',6'-dihydro-4'H-spiro[chromene-2,3'-pyran]-4(3H)-ylidene)-2-methylpropane-2-sulfinamide
IUPAC
N-(6-bromospiro[3H-chromene-2,3'-oxane]-4-ylidene)-2-methylpropane-2-sulfinamide

Names & synonyms

SCHEMBL9947904SCHEMBL9947905SCHEMBL9947906SCHEMBL14054115SCHEMBL14129080JFIQOJPCUVCJLX-UHFFFAOYSA-NUS8865911, 227N-(6-Bromo-5',6'-dihydro-4'H-spiro[chromene-2,3'-pyran]-4(3H)-ylidene)-2-methylpropane-2-sulfinamide

Database identifiers

PubChem CID
67979337

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
67.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
23

Related reactions

7 records

Compound notes

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