Structure

Capravirine

CAS
178979-85-6
Catalog Number
ACM178979856
Category
Other Products
Molecular Weight
451.369 g/mol
Molecular Formula
C20H20Cl2N4O2S

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Specification

Synonyms
Capravirine, CDIMI, Capravirine (USAN/INN), UNII-VHC779598X, CID1783, AIDS058025, AG 1549, AG-1549, AIDS-058025, AG1549, ZINC00538635, S 1153, S-1153, LS-183350, D03371, 178979-85-6, 1H-Imidazole-2-methanol, 5-((3,5-dichlorophenyl)thio)-4-(1-methylethyl)-1-(4-pyridinylmethyl)-, carbamate (ester), S11, 253199-04-1, 5-((3,5-Dichlorophenyl)thio)-4-isopropyl-1-(4-pyridylmethyl)imidazole-2-methanol carbamate (ester)
IUPAC Name
[5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]methyl carbamate
Canonical SMILES
CC(C)C1=C(N(C(=N1)COC(=O)N)CC2=CC=NC=C2)SC3=CC(=CC(=C3)Cl)Cl
InChI Key
YQXCVAGCMNFUMQ-UHFFFAOYSA-N
Boiling Point
646ºC at 760mmHg
Flash Point
344.5ºC
Density
1.4g/cm³
Exact Mass
450.06800
H-Bond Acceptor
4
H-Bond Donor
1
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