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86625-91-4 | 6-Methyl-5-thioxotetrahydro-7H-imidazo[1,5-c][1,3]thiazol-7-one
CAS No: 86625-91-4 Catalog No: AG004KZZ MDL No:
Product Description
Catalog Number:
AG004KZZ
Chemical Name:
6-Methyl-5-thioxotetrahydro-7H-imidazo[1,5-c][1,3]thiazol-7-one
CAS Number:
86625-91-4
Molecular Formula:
C6H8N2OS2
Molecular Weight:
188.2705
IUPAC Name:
6-methyl-5-sulfanylidene-3,7a-dihydro-1H-imidazo[1,5-c][1,3]thiazol-7-one
InChI:
InChI=1S/C6H8N2OS2/c1-7-5(9)4-2-11-3-8(4)6(7)10/h4H,2-3H2,1H3
InChI Key:
NHXOSEFPMNWWGP-UHFFFAOYSA-N
SMILES:
O=C1N(C)C(=S)N2C1CSC2
NSC Number:
372360
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.008g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.263g/mol
Monoisotopic Mass:
188.008g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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