Name: Name:N-[3-(3-sulfanyl-4H-1,2,4-triazol-4-yl)phenyl]acetamide
Brand: Angene
SKU: AG019LGK
Rating: 90 (10 reviews)

N-[3-(3-sulfanyl-4H-1,2,4-triazol-4-yl)phenyl]acetamide

CAS No.:

167219-58-1

Catalog Number:

AG019LGK

Molecular Formula:

C10H10N4OS

Molecular Weight:

234.2776

Catalog Number:

AG019LGK

Chemical Name:

N-[3-(3-sulfanyl-4H-1,2,4-triazol-4-yl)phenyl]acetamide

CAS Number:

167219-58-1

Molecular Formula:

C10H10N4OS

Molecular Weight:

234.2776

MDL Number:

MFCD09971416

IUPAC Name:

N-[3-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)phenyl]acetamide

InChI:

InChI=1S/C10H10N4OS/c1-7(15)12-8-3-2-4-9(5-8)14-6-11-13-10(14)16/h2-6H,1H3,(H,12,15)(H,13,16)

InChI Key:

AZIJEGBNIFORAP-UHFFFAOYSA-N

SMILES:

CC(=O)Nc1cccc(c1)n1cnnc1S

Complexity:

331

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

234.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

234.277g/mol

Monoisotopic Mass:

234.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

88.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7