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N-{5-[(4-bromophenyl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene}naphthalene-1-sulfonamide

N-{5-[(4-bromophenyl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene}naphthalene-1-sulfonamide

CAS: 1332879-52-3

Formula: C20H13BrN2O3S2

SMILES: BrC1=CC=C(C=C2SC(NC2=O)=NS(=O)(=O)C2=C3C=CC=CC3=CC=C2)C=C1

IUPAC: N-{5-[(4-bromophenyl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene}naphthalene-1-sulfonamide

InChI: InChI=1S/C20H13BrN2O3S2/c21-15-10-8-13(9-11-15)12-17-19(24)22-20(27-17)23-28(25,26)18-7-3-5-14-4-1-2-6-16(14)18/h1-12H,(H,22,23,24)

Composition: C (50.75%), H (2.77%), Br (16.88%), N (5.92%), O (10.14%), S (13.55%)

Molar Mass: 473.36

Atom Count: 41

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 471.955098
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey CGDLWHGPJPVPDU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 115.47
Topological Polar Surface Area 75.6
Polarizability 45.71
Ring Count 4
Rotatable Bond Count 2

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