[(2S)-2-[4-(cyclopropylmethyl)piperazin-4-ium-1-yl]-2-thiophen-2-yl-ethyl]azanium

Systemtic Name: [(2S)-2-[4-(cyclopropylmethyl)piperazin-4-ium-1-yl]-2-thiophen-2-yl-ethyl]azanium Openeye Name: [(2S)-2-[4-(cyclopropylmethyl)piperazin-4-ium-1-yl]-2-(2-thienyl)ethyl]ammonium CAS Name: [(2S)-2-[4-(cyclopropylmethyl)-1-piperazin-4-iumyl]-2-thiophen-2-ylethyl]ammonium IUPAC Name: [(2S)-2-[4-(cyclopropylmethyl)piperazin-4-ium-1-yl]-2-thiophen-2-ylethyl]azanium Traditional Name: [(2S)-2-[4-(cyclopropylmethyl)piperazin-4-ium-1-yl]-2-(2-thienyl)ethyl]ammonium Formula: C14H25N3S+2 MolecularWeight: 267.4334

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C[NH+]2CCN(CC2)C(C[NH3+])C3=CC=CS3

Isomeric SMILES

C1CC1C[NH+]2CCN(CC2)[C@@H](C[NH3+])C3=CC=CS3

InChI

InChI=1S/C14H23N3S/c15-10-13(14-2-1-9-18-14)17-7-5-16(6-8-17)11-12-3-4-12/h1-2,9,12-13H,3-8,10-11,15H2/p+2/t13-/m0/s1