Name: Name:2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Brand: Angene
SKU: AG01A0PU
Rating: 90 (10 reviews)

2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

CAS No.:

893726-11-9

Catalog Number:

AG01A0PU

Molecular Formula:

C17H16ClN5OS

Molecular Weight:

373.8598

Catalog Number:

AG01A0PU

Chemical Name:

2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

CAS Number:

893726-11-9

Molecular Formula:

C17H16ClN5OS

Molecular Weight:

373.8598

MDL Number:

MFCD07364284

IUPAC Name:

2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetohydrazide

InChI:

InChI=1S/C17H16ClN5OS/c1-11-2-8-14(9-3-11)23-16(12-4-6-13(18)7-5-12)21-22-17(23)25-10-15(24)20-19/h2-9H,10,19H2,1H3,(H,20,24)

InChI Key:

RCQBNEPADSUTKS-UHFFFAOYSA-N

SMILES:

NNC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl

Complexity:

441

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

373.076g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

373.859g/mol

Monoisotopic Mass:

373.076g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

111A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2