Chemical ID: 5840216

Cc1ccc(cc1)S(=O)(=O)N=C2NC(=O)C(=Cc3ccc(o3)C)S2
Chemical ID:
5840216
Name [?]:
4-methyl-N-[5-[(5-methyl-2-furyl)methylene]-4-oxo-thiazolidin-2-ylidene]-benzenesulfonamide
SMILES [?]:
Cc1ccc(cc1)S(=O)(=O)N=C2NC(=O)C(=Cc3ccc(o3)C)S2
InChi [?]:
InChI=1/C16H14N2O4S2/c1-10-3-7-13(8-4-10)24(20,21)18-16-17-15(19)14(23-16)9-12-6-5-11(2)22-12/h3-9H,1-2H3,(H,17,18,19)
InChi Info:
AuxInfo=1/1/N:1,23,3,7,20,19,4,6,17,2,21,18,5,16,14,12,13,11,15,9,10,22,24,8/E:(3,4)(7,8)(20,21)/CRV:24.6/rA:24nCCCCCCCSOONCNCOCCCCCCOCS/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;d8;s8;w11;s12;s13;d14;s14;w16;s17;d18;s19;d20;s18s21;s21;s12s16;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14N2O4S2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.134
Area:550.093
Solvation:-3.61838
Coulombic:-34.4274
Bond Count [?]
All:26
Single:16
Double:10
Rotors:3
Chiral:2
Rigid Segments:4
Chemical Properties
Molecular Weight:362.425
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.23
LogP (Chemaxon):2.94

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Descriptor Annotations

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