Cefrotil

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Catalog Number
ACM52231206
Product Name
Cefrotil
Structure
Structure
CAS
52231-20-6
Category
Heterocyclic Organic Compound
Synonyms
Cefrotilum, Cefrotil, Cefrotilo, Cefrotilum [INN-Latin], Cefrotilo [INN-Spanish], UNII-44P98H0A27, CID68692, HR 580, (6R,7R)-3-Methyl-8-oxo-7-(2-(p-(1,4,5,6-tetrahydro-2-pyrimidinyl)phenyl)acetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-Methyl-8-oxo-7-(((4-(1,4,5,6R-trans-tetrahydro-2-pyrimidinyl)phenyl)acetyl)amino)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-methyl-8-oxo-7-(((4-(1,4,5,6-tetrahydro-2-pyrimidinyl)phenyl)acetyl)amino)-, (6R,7R)-, 52231-20-6
IUPAC Name
(6R,7R)-3-methyl-8-oxo-7-[[2-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Molecular Weight
414.478 g/mol
Molecular Formula
C20H22N4O4S
Canonical SMILES
CC1=C(N2C(C(C2=O)NC(=O)CC3=CC=C(C=C3)C4=NCCCN4)SC1)C(=O)O
InChI Key
QFTZCQVZVRVDTD-DNVCBOLYSA-N
Boiling Point
823.6ºC at 760mmHg
Flash Point
451.9ºC
Density
1.54g/cm³
Exact Mass
414.13600
H-Bond Acceptor
6
H-Bond Donor
3
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