N-[(Phenylcarbamothioyl)amino]pyridine-3-carboxamide structure

N-[(Phenylcarbamothioyl)amino]pyridine-3-carboxamide

1-phenyl-3-(pyridine-3-carbonylamino)thiourea

Also Known As: Maybridge1_000331|CBMicro_036215|HMS542H01|1-nicotinoyl-4-phenyl-3-thiosemicarbazide|1-phenyl-3-(pyridine-3-carbonylamino)thiourea|BIM-0036217.P001|UPCMLD0ENAT0400-4053:001|2-nicotinoyl-N-phenylhydrazinecarbothioamide|1-(3-Pyridinylcarbonyl)-4-phenylthiosemicarbazide|N-[(PHENYLCARBAMOTHIOYL)AMINO]PYRIDINE-3-CARBOXAMIDE|N-phenyl-2-(3-pyridinylcarbonyl)hydrazinecarbothioamide|N-phenyl-2-(pyridin-3-ylcarbonyl)hydrazinecarbothioamide

CAS: 54584-49-5
Molecular Formula C13H12N4OS
Molecular Weight 272.07318 g/mol
LogP 1.7
Topological Polar Surface Area 98.1 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 3
Rotatable Bonds 2
Exact Mass 272.07318
Monoisotopic Mass 272.07318
Heavy Atoms 19
Complexity 318.0

Chemical Identifiers

CAS Number 54584-49-5
SMILES C1=CC=C(C=C1)NC(=S)NNC(=O)C2=CN=CC=C2
InChIKey FYQYTFJUWMJHMW-UHFFFAOYSA-N

Product Overview

N-[(Phenylcarbamothioyl)amino]pyridine-3-carboxamide (CAS 54584-49-5), with molecular formula C13H12N4OS and molecular weight 272.07318 g/mol. IUPAC: 1-phenyl-3-(pyridine-3-carbonylamino)thiourea.

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