S-(1-Phenyl-5-tetrazolyl) chlorothioformate

HCID 86028543
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Basic information

Standard SMILES
O=C(Cl)Sc1nnnn1-c1ccccc1
InChIKey
TYKZPIQMOLDURI-UHFFFAOYSA-N
Molecular formula
C8H5ClN4OS
Average molar mass
240.67 g/mol

Names & identifiers

Preferred name
S-(1-Phenyl-5-tetrazolyl) chlorothioformate
IUPAC
S-(1-phenyltetrazol-5-yl) chloromethanethioate

Names & synonyms

S-(1-Phenyl-5-tetrazolyl) chlorothioformateSCHEMBL7346231TYKZPIQMOLDURI-UHFFFAOYSA-N

Database identifiers

PubChem CID
86028543

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
86 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
15

Related reactions

2 records
New reaction record

Linked notes

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