4-[4-(3-thiophen-2-ylpropyl)piperazin-4-ium-1-yl]aniline

Systemtic Name: 4-[4-(3-thiophen-2-ylpropyl)piperazin-4-ium-1-yl]aniline Openeye Name: 4-[4-[3-(2-thienyl)propyl]piperazin-4-ium-1-yl]aniline CAS Name: 4-[4-(3-thiophen-2-ylpropyl)-1-piperazin-4-iumyl]aniline IUPAC Name: 4-[4-(3-thiophen-2-ylpropyl)piperazin-4-ium-1-yl]aniline Traditional Name: [4-[4-[3-(2-thienyl)propyl]piperazin-4-ium-1-yl]phenyl]amine Formula: C17H24N3S+ MolecularWeight: 302.45756

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC2=CC=CS2)C3=CC=C(C=C3)N

Isomeric SMILES

C1CN(CC[NH+]1CCCC2=CC=CS2)C3=CC=C(C=C3)N

InChI

InChI=1S/C17H23N3S/c18-15-5-7-16(8-6-15)20-12-10-19(11-13-20)9-1-3-17-4-2-14-21-17/h2,4-8,14H,1,3,9-13,18H2/p+1