Chemical ID: 4296433

CN(C)c1ccc(cc1)C=C2C(=O)N(C(=O)S2)c3ccccc3
Chemical ID:
4296433
Name [?]:
5-[(4-dimethylaminophenyl)methylene]-3-phenyl-thiazolidine-2,4-dione
SMILES [?]:
CN(C)c1ccc(cc1)C=C2C(=O)N(C(=O)S2)c3ccccc3
InChi [?]:
InChI=1/C18H16N2O2S/c1-19(2)14-10-8-13(9-11-14)12-16-17(21)20(18(22)23-16)15-6-4-3-5-7-15/h3-12H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,21,20,22,19,23,6,8,5,9,10,7,4,18,11,12,15,2,14,13,16,17/E:(1,2)(4,5)(6,7)(8,9)(10,11)/rA:23nCNCCCCCCCCCCONCOSCCCCCC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;w10;s11;d12;s12;s14;d15;s11s15;s14;s18;d19;s20;d21;d18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H16N2O2S
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.96671
Area:517.051
Solvation:-2.95956
Coulombic:-35.2302
Bond Count [?]
All:25
Single:16
Double:9
Rotors:3
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:324.398
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:3.35
LogP (Chemaxon):4.02

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