Text Search
Structure Search

4-[5-(naphthalen-1-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

4-[5-(naphthalen-1-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

Formula: C18H15NO3S2

SMILES: OC(=O)CCCN1C(=S)SC(=CC2=C3C=CC=CC3=CC=C2)C1=O

IUPAC: 4-{5-[(naphthalen-1-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}butanoic acid

InChI: InChI=1S/C18H15NO3S2/c20-16(21)9-4-10-19-17(22)15(24-18(19)23)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-3,5-8,11H,4,9-10H2,(H,20,21)

Composition: C (60.48%), H (4.23%), N (3.92%), O (13.43%), S (17.94%)

Molar Mass: 357.44

Atom Count: 39

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 357.049335695
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey NMYDPSCPARBVHD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 101.1
Topological Polar Surface Area 57.61
Polarizability 39.88
Ring Count 3
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
97% <7 Days C18H15NO3S2 $46.75-$74.80$46.75$74.80
Request Quote
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C18H15NO3S2 Quote Only
Request Quote