1-Propanamine, N,N-dimethyl-3-thieno(3,2-c)(2)benzothiepin-10(5H)-ylidene-, hydrochloride

HCID 6445824

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 42505-71-5
Standard SMILES: CN(C)CC/C=C1\c2ccccc2CSc2ccsc21.Cl
InChIKey: XGNKZQYKUBCFQV-TWNLEINFSA-N
Molecular formula: C17H20ClNS2
Average molar mass: 337.9 g/mol
Monoisotopic mass: 337.0725697

Names & identifiers

Preferred name: 1-Propanamine, N,N-dimethyl-3-thieno(3,2-c)(2)benzothiepin-10(5H)-ylidene-, hydrochloride
IUPAC: (3E)-N,N-dimethyl-3-(5H-thieno[3,2-c][2]benzothiepin-10-ylidene)propan-1-amine;hydrochloride

Names & synonyms

1-Propanamine, N,N-dimethyl-3-thieno(3,2-c)(2)benzothiepin-10(5H)-ylidene-, hydrochloride42505-71-5RefChem:1056868N,N-Dimethyl-3-thieno(3,2-c)(2)benzothiepin-10(5H)-ylidene-1-propanamine hydrochloride10-(3-Dimethylaminopropylidene)-5,10-dihydrothieno(3,2-c)-2-benzothiepin hydrochloride

Database identifiers

CAS: 42505-71-5
PubChem CID: 6445824

Properties

Computed structural properties

Topological polar surface area: 56.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 21
Formal charge: 0
Complexity: 353

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…