[(3S)-3-[4-(4-methoxyphenyl)piperazin-1-yl]thiolan-3-yl]methylazanium

Systemtic Name: [(3S)-3-[4-(4-methoxyphenyl)piperazin-1-yl]thiolan-3-yl]methylazanium Openeye Name: [(3S)-3-[4-(4-methoxyphenyl)piperazin-1-yl]tetrahydrothiophen-3-yl]methylammonium CAS Name: [(3S)-3-[4-(4-methoxyphenyl)-1-piperazinyl]-3-thiolanyl]methylammonium IUPAC Name: [(3S)-3-[4-(4-methoxyphenyl)piperazin-1-yl]thiolan-3-yl]methylazanium Traditional Name: [(3S)-3-[4-(4-methoxyphenyl)piperazino]tetrahydrothiophen-3-yl]methylammonium Formula: C16H26N3OS+ MolecularWeight: 308.46214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3(CCSC3)C[NH3+]

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)[C@@]3(CCSC3)C[NH3+]

InChI

InChI=1S/C16H25N3OS/c1-20-15-4-2-14(3-5-15)18-7-9-19(10-8-18)16(12-17)6-11-21-13-16/h2-5H,6-13,17H2,1H3/p+1/t16-/m0/s1