Chemical ID: 7143319

CN(C)c1ccc(cc1)C=C2C(=O)N=C(S2)Nc3ccc(cc3OC)OC
Chemical ID:
7143319
Name [?]:
2-(2,4-dimethoxyphenyl)amino-5-[(4-dimethylaminophenyl)methylene]thiazol-4-one
SMILES [?]:
CN(C)c1ccc(cc1)C=C2C(=O)N=C(S2)Nc3ccc(cc3OC)OC
InChi [?]:
InChI=1/C20H21N3O3S/c1-23(2)14-7-5-13(6-8-14)11-18-19(24)22-20(27-18)21-16-10-9-15(25-3)12-17(16)26-4/h5-12H,1-4H3,(H,21,22,24)
InChi Info:
AuxInfo=1/1/N:1,3,27,25,6,8,5,9,20,19,10,22,7,4,21,18,23,11,12,15,17,14,2,13,26,24,16/E:(1,2)(5,6)(7,8)/rA:27nCNCCCCCCCCCCONCSNCCCCCCOCOC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;w10;s11;d12;s12;d14;s11s15;s15;s17;s18;d19;s20;d21;d18s22;s23;s24;s21;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H21N3O3S
All Atoms:48
Heavy Atoms:27
Chiral Atoms:None
ZAP Information [?]
Total:10.7135
Area:606.775
Solvation:-4.45588
Coulombic:-50.1211
Bond Count [?]
All:29
Single:20
Double:9
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.39
LogP (Chemaxon):None

Name Annotations

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Descriptor Annotations

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