Chemical ID: 3967433

CC(=O)N=c1n(nc(s1)S(=O)(=O)N)C
Chemical ID:
3967433
Name [?]:
N-(3-methyl-5-sulfamoyl-1,3,4-thiadiazol-2-ylidene)acetamide
SMILES [?]:
CC(=O)N=c1n(nc(s1)S(=O)(=O)N)C
InChi [?]:
InChI=1/C5H8N4O3S2/c1-3(10)7-4-9(2)8-5(13-4)14(6,11)12/h1-2H3,(H2,6,11,12)
InChi Info:
AuxInfo=1/1/N:1,14,2,5,8,13,4,7,6,3,11,12,9,10/E:(11,12)/CRV:14.6/rA:14nCCONCNNCSSOONC/rB:s1;d2;s2;w4;s5;s6;d7;s5s8;s8;d10;d10;s10;s6;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H8N4O3S2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.45743
Area:380.141
Solvation:-3.04609
Coulombic:-37.4977
Bond Count [?]
All:14
Single:9
Double:5
Rotors:2
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:236.274
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:-1.33
LogP (Chemaxon):-0.32

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Descriptor Annotations

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