Name: Name:3-methyl-2-sulfanyl-3H,4H-thieno[3,2-d]pyrimidin-4-one
Brand: Angene
SKU: AG019PK7
Rating: 90 (10 reviews)

3-methyl-2-sulfanyl-3H,4H-thieno[3,2-d]pyrimidin-4-one

CAS No.:

183170-82-3

Catalog Number:

AG019PK7

Molecular Formula:

C7H6N2OS2

Molecular Weight:

198.2653

Catalog Number:

AG019PK7

Chemical Name:

3-methyl-2-sulfanyl-3H,4H-thieno[3,2-d]pyrimidin-4-one

CAS Number:

183170-82-3

Molecular Formula:

C7H6N2OS2

Molecular Weight:

198.2653

MDL Number:

MFCD07850257

IUPAC Name:

3-methyl-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-4-one

InChI:

InChI=1S/C7H6N2OS2/c1-9-6(10)5-4(2-3-12-5)8-7(9)11/h2-3H,1H3,(H,8,11)

InChI Key:

NUWPXBHTEMDQJU-UHFFFAOYSA-N

SMILES:

Cn1c(S)nc2c(c1=O)scc2

Complexity:

244

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

197.992g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

198.258g/mol

Monoisotopic Mass:

197.992g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

92.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2