4-[4-(phenylmethyl)piperazin-4-ium-1-yl]-N-(thiophen-2-ylmethyl)aniline

Systemtic Name: 4-[4-(phenylmethyl)piperazin-4-ium-1-yl]-N-(thiophen-2-ylmethyl)aniline Openeye Name: 4-(4-benzylpiperazin-4-ium-1-yl)-N-(2-thienylmethyl)aniline CAS Name: 4-[4-(phenylmethyl)-1-piperazin-4-iumyl]-N-(thiophen-2-ylmethyl)aniline IUPAC Name: 4-(4-benzylpiperazin-4-ium-1-yl)-N-(thiophen-2-ylmethyl)aniline Traditional Name: [4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-(2-thenyl)amine Formula: C22H26N3S+ MolecularWeight: 364.52694

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)NCC4=CC=CS4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)NCC4=CC=CS4

InChI

InChI=1S/C22H25N3S/c1-2-5-19(6-3-1)18-24-12-14-25(15-13-24)21-10-8-20(9-11-21)23-17-22-7-4-16-26-22/h1-11,16,23H,12-15,17-18H2/p+1