Chemical ID: 4132881

CCn1c(c(sc1=S)C(=O)NC)N
Chemical ID:
4132881
Name [?]:
4-amino-3-ethyl-N-methyl-2-thioxo-thiazole-5-carboxamide
SMILES [?]:
CCn1c(c(sc1=S)C(=O)NC)N
InChi [?]:
InChI=1/C7H11N3OS2/c1-3-10-5(8)4(6(11)9-2)13-7(10)12/h3,8H2,1-2H3,(H,9,11)
InChi Info:
AuxInfo=1/1/N:1,12,2,5,4,9,7,13,11,3,10,8,6/rA:13nCCNCCSCSCONCN/rB:s1;s2;s3;d4;s5;s3s6;d7;s5;d9;s9;s11;s4;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H11N3OS2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:8.06424
Area:374.837
Solvation:-1.30669
Coulombic:-46.0701
Bond Count [?]
All:13
Single:10
Double:3
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:217.314
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:0.91
LogP (Chemaxon):0.68

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Descriptor Annotations

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