5-(4-ethyl-1,4-diazepan-1-yl)-8-thiophen-3-yl-2-(trifluoromethyl)-1,6-naphthyridine hydrochloride

Systemtic Name: 5-(4-ethyl-1,4-diazepan-1-yl)-8-thiophen-3-yl-2-(trifluoromethyl)-1,6-naphthyridine hydrochloride Openeye Name: 5-(4-ethyl-1,4-diazepan-1-yl)-8-(3-thienyl)-2-(trifluoromethyl)-1,6-naphthyridine hydrochloride CAS Name: 5-(4-ethyl-1,4-diazepan-1-yl)-8-(3-thiophenyl)-2-(trifluoromethyl)-1,6-naphthyridine hydrochloride IUPAC Name: 5-(4-ethyl-1,4-diazepan-1-yl)-8-thiophen-3-yl-2-(trifluoromethyl)-1,6-naphthyridine hydrochloride Traditional Name: 5-(4-ethyl-1,4-diazepan-1-yl)-8-(3-thienyl)-2-(trifluoromethyl)-1,6-naphthyridine hydrochloride Formula: C20H22ClF3N4S MolecularWeight: 442.92869

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCN(CC1)C2=NC=C(C3=C2C=CC(=N3)C(F)(F)F)C4=CSC=C4.Cl

Isomeric SMILES

CCN1CCCN(CC1)C2=NC=C(C3=C2C=CC(=N3)C(F)(F)F)C4=CSC=C4.Cl

InChI

InChI=1S/C20H21F3N4S.ClH/c1-2-26-7-3-8-27(10-9-26)19-15-4-5-17(20(21,22)23)25-18(15)16(12-24-19)14-6-11-28-13-14;/h4-6,11-13H,2-3,7-10H2,1H3;1H