furan-2-ylmethyl-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: furan-2-ylmethyl-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: 2-furylmethyl-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-(2-thienylmethyl)ammonium CAS Name: 2-furanylmethyl-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: furan-2-ylmethyl-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: 2-furfuryl-[2-keto-2-(4-phenylpiperazino)ethyl]-(2-thenyl)ammonium Formula: C22H26N3O2S+ MolecularWeight: 396.52574

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C[NH+](CC3=CC=CO3)CC4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C[NH+](CC3=CC=CO3)CC4=CC=CS4

InChI

InChI=1S/C22H25N3O2S/c26-22(25-12-10-24(11-13-25)19-6-2-1-3-7-19)18-23(16-20-8-4-14-27-20)17-21-9-5-15-28-21/h1-9,14-15H,10-13,16-18H2/p+1