(2R)-N-methyl-N-phenyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-methyl-N-phenyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-methyl-N-phenyl-2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-N-methyl-N-phenyl-2-[4-(2-thiazolyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-methyl-N-phenyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-methyl-N-phenyl-2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)propionamide Formula: C17H23N4OS+ MolecularWeight: 331.45572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1=CC=CC=C1)[NH+]2CCN(CC2)C3=NC=CS3

Isomeric SMILES

C[C@H](C(=O)N(C)C1=CC=CC=C1)[NH+]2CCN(CC2)C3=NC=CS3

InChI

InChI=1S/C17H22N4OS/c1-14(16(22)19(2)15-6-4-3-5-7-15)20-9-11-21(12-10-20)17-18-8-13-23-17/h3-8,13-14H,9-12H2,1-2H3/p+1/t14-/m1/s1