1-[(S)-(3-methyl-1H-imidazol-3-ium-2-yl)-thiophen-2-yl-methyl]piperazine

Systemtic Name: 1-[(S)-(3-methyl-1H-imidazol-3-ium-2-yl)-thiophen-2-yl-methyl]piperazine Openeye Name: 1-[(S)-(3-methyl-1H-imidazol-3-ium-2-yl)-(2-thienyl)methyl]piperazine CAS Name: 1-[(S)-(3-methyl-1H-imidazol-3-ium-2-yl)-thiophen-2-ylmethyl]piperazine IUPAC Name: 1-[(S)-(3-methyl-1H-imidazol-3-ium-2-yl)-thiophen-2-ylmethyl]piperazine Traditional Name: 1-[(S)-(3-methyl-1H-imidazol-3-ium-2-yl)-(2-thienyl)methyl]piperazine Formula: C13H19N4S+ MolecularWeight: 263.38176

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1)C(C2=CC=CS2)N3CCNCC3

Isomeric SMILES

C[N+]1=C(NC=C1)[C@@H](C2=CC=CS2)N3CCNCC3

InChI

InChI=1S/C13H18N4S/c1-16-7-6-15-13(16)12(11-3-2-10-18-11)17-8-4-14-5-9-17/h2-3,6-7,10,12,14H,4-5,8-9H2,1H3/p+1/t12-/m1/s1