Name: Name:3-(1,1-dioxo-1lambda6-thiomorpholin-4-yl)-3-oxopropanenitrile
Brand: Angene
SKU: AG01AHR1
Rating: 90 (10 reviews)

3-(1,1-dioxo-1lambda6-thiomorpholin-4-yl)-3-oxopropanenitrile

CAS No.:

1154379-97-1

Catalog Number:

AG01AHR1

Molecular Formula:

C7H10N2O3S

Molecular Weight:

202.2309

Catalog Number:

AG01AHR1

Chemical Name:

3-(1,1-dioxo-1lambda6-thiomorpholin-4-yl)-3-oxopropanenitrile

CAS Number:

1154379-97-1

Molecular Formula:

C7H10N2O3S

Molecular Weight:

202.2309

MDL Number:

MFCD12142668

IUPAC Name:

3-(1,1-dioxo-1,4-thiazinan-4-yl)-3-oxopropanenitrile

InChI:

InChI=1S/C7H10N2O3S/c8-2-1-7(10)9-3-5-13(11,12)6-4-9/h1,3-6H2

InChI Key:

VGQJPBWISXNCRV-UHFFFAOYSA-N

SMILES:

N#CCC(=O)N1CCS(=O)(=O)CC1

Complexity:

332

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

202.041g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

202.228g/mol

Monoisotopic Mass:

202.041g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.2