(2S)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)-3,4-dihydro-2H-quinoline-1-carbothioamide

Systemtic Name: (2S)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)-3,4-dihydro-2H-quinoline-1-carbothioamide Openeye Name: (2S)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)-3,4-dihydro-2H-quinoline-1-carbothioamide CAS Name: (2S)-2-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]-3,4-dihydro-2H-quinoline-1-carbothioamide IUPAC Name: (2S)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)-3,4-dihydro-2H-quinoline-1-carbothioamide Traditional Name: (2S)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)-3,4-dihydro-2H-quinoline-1-carbothioamide Formula: C17H26N3OS+ MolecularWeight: 320.47284

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=CC=CC=C2N1C(=S)NCC[NH+]3CCOCC3

Isomeric SMILES

C[C@H]1CCC2=CC=CC=C2N1C(=S)NCC[NH+]3CCOCC3

InChI

InChI=1S/C17H25N3OS/c1-14-6-7-15-4-2-3-5-16(15)20(14)17(22)18-8-9-19-10-12-21-13-11-19/h2-5,14H,6-13H2,1H3,(H,18,22)/p+1/t14-/m0/s1