Chemical ID: 7142924

CC(=O)Nc1ccc(cc1)NC2=NC(=O)C(=Cc3ccc(cc3)OC)S2
Chemical ID:
7142924
Name [?]:
N-[4-[5-[(4-methoxyphenyl)methylene]-4-oxo-thiazol-2-yl]aminophenyl]acetamide
SMILES [?]:
CC(=O)Nc1ccc(cc1)NC2=NC(=O)C(=Cc3ccc(cc3)OC)S2
InChi [?]:
InChI=1/C19H17N3O3S/c1-12(23)20-14-5-7-15(8-6-14)21-19-22-18(24)17(26-19)11-13-3-9-16(25-2)10-4-13/h3-11H,1-2H3,(H,20,23)(H,21,22,24)
InChi Info:
AuxInfo=1/1/N:1,25,19,23,6,10,7,9,20,22,17,2,18,5,8,21,16,14,12,4,11,13,3,15,24,26/E:(3,4)(5,6)(7,8)(9,10)/rA:26nCCONCCCCCCNCNCOCCCCCCCCOCS/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;s11;d12;s13;d14;s14;w16;s17;s18;d19;s20;d21;d18s22;s21;s24;s12s16;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H17N3O3S
All Atoms:43
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:10.0635
Area:584.094
Solvation:-4.53889
Coulombic:-54.9937
Bond Count [?]
All:28
Single:18
Double:10
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.1
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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