Chemical ID: 6606574

c1(nc([nH]n1)S)N
Chemical ID:
6606574
Name [?]:
5-amino-2H-1,2,4-triazole-3-thiol
SMILES [?]:
c1(nc([nH]n1)S)N
InChi [?]:
InChI=1/C2H4N4S/c3-1-4-2(7)6-5-1/h(H4,3,4,5,6,7)
InChi Info:
AuxInfo=1/1/N:1,3,7,2,5,4,6/rA:7nCNCNNSN/rB:s1;d2;s3;d1s4;s3;s1;/rC:;;;;;;;

Chemical Details

Atom Count
Formula:C2H4N4S
All Atoms:7
Heavy Atoms:7
Chiral Atoms:0
ZAP Information [?]
Total:5.00656
Area:253.368
Solvation:-1.32764
Coulombic:-35.1433
Bond Count [?]
All:7
Single:5
Double:2
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:116.146
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:-0.01
LogP (Chemaxon):0.46

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Experimental Annotations

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Descriptor Annotations

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