Name: Name:3-(5-amino-1,3,4-oxadiazol-2-yl)benzene-1-carbothioamide
Brand: Angene
SKU: AG019XXN
Rating: 90 (10 reviews)

3-(5-amino-1,3,4-oxadiazol-2-yl)benzene-1-carbothioamide

CAS No.:

1223354-08-2

Catalog Number:

AG019XXN

Molecular Formula:

C9H8N4OS

Molecular Weight:

220.2510

Catalog Number:

AG019XXN

Chemical Name:

3-(5-amino-1,3,4-oxadiazol-2-yl)benzene-1-carbothioamide

CAS Number:

1223354-08-2

Molecular Formula:

C9H8N4OS

Molecular Weight:

220.2510

MDL Number:

MFCD13368242

IUPAC Name:

3-(5-amino-1,3,4-oxadiazol-2-yl)benzenecarbothioamide

InChI:

InChI=1S/C9H8N4OS/c10-7(15)5-2-1-3-6(4-5)8-12-13-9(11)14-8/h1-4H,(H2,10,15)(H2,11,13)

InChI Key:

QHMNKYTYUZYLLA-UHFFFAOYSA-N

SMILES:

Nc1nnc(o1)c1cccc(c1)C(=S)N

Complexity:

250

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.042g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.25g/mol

Monoisotopic Mass:

220.042g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

123A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5