Name: Name:5-(4-Phenoxy-phenylamino)-[1,3,4]thiadiazole-2-thiol
Brand: Angene
SKU: AG00I7HN
Rating: 90 (10 reviews)

5-(4-Phenoxy-phenylamino)-[1,3,4]thiadiazole-2-thiol

CAS No.:

380431-13-0

Catalog Number:

AG00I7HN

Molecular Formula:

C14H11N3OS2

Molecular Weight:

301.3866

Catalog Number:

AG00I7HN

Chemical Name:

5-(4-Phenoxy-phenylamino)-[1,3,4]thiadiazole-2-thiol

CAS Number:

380431-13-0

Molecular Formula:

C14H11N3OS2

Molecular Weight:

301.3866

MDL Number:

MFCD03150680

IUPAC Name:

5-(4-phenoxyanilino)-3H-1,3,4-thiadiazole-2-thione

InChI:

InChI=1S/C14H11N3OS2/c19-14-17-16-13(20-14)15-10-6-8-12(9-7-10)18-11-4-2-1-3-5-11/h1-9H,(H,15,16)(H,17,19)

InChI Key:

XJOJTXVYSRMVJY-UHFFFAOYSA-N

SMILES:

Sc1nnc(s1)Nc1ccc(cc1)Oc1ccccc1

Complexity:

375

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

301.034g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

301.382g/mol

Monoisotopic Mass:

301.034g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

103A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8