Name: Name:4-amino-3-thiatricyclo[5.2.1.0,2,6]deca-2(6),4-diene-5-carbonitrile
Brand: Angene
SKU: AG01AMVJ
Rating: 90 (10 reviews)

4-amino-3-thiatricyclo[5.2.1.0,2,6]deca-2(6),4-diene-5-carbonitrile

CAS No.:

60948-80-3

Catalog Number:

AG01AMVJ

Molecular Formula:

C10H10N2S

Molecular Weight:

190.2648

Catalog Number:

AG01AMVJ

Chemical Name:

4-amino-3-thiatricyclo[5.2.1.0,2,6]deca-2(6),4-diene-5-carbonitrile

CAS Number:

60948-80-3

Molecular Formula:

C10H10N2S

Molecular Weight:

190.2648

MDL Number:

MFCD24121282

IUPAC Name:

4-amino-3-thiatricyclo[5.2.1.02,6]deca-2(6),4-diene-5-carbonitrile

InChI:

InChI=1S/C10H10N2S/c11-4-7-8-5-1-2-6(3-5)9(8)13-10(7)12/h5-6H,1-3,12H2

InChI Key:

MMGVXNCBGQVBRS-UHFFFAOYSA-N

SMILES:

N#Cc1c(N)sc2c1C1CCC2C1

Complexity:

282

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.056g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.264g/mol

Monoisotopic Mass:

190.056g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5