N-[3-[(S)-morpholin-4-ium-4-yl(pyridin-3-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]ethanamide

Systemtic Name: N-[3-[(S)-morpholin-4-ium-4-yl(pyridin-3-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]ethanamide Openeye Name: N-[3-[(S)-morpholin-4-ium-4-yl(3-pyridyl)methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]acetamide CAS Name: N-[3-[(S)-4-morpholin-4-iumyl(3-pyridinyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]acetamide IUPAC Name: N-[3-[(S)-morpholin-4-ium-4-yl(pyridin-3-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]acetamide Traditional Name: N-[3-[(S)-morpholin-4-ium-4-yl(3-pyridyl)methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]acetamide Formula: C20H26N3O2S+ MolecularWeight: 372.50434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=C(S1)CCCC2)C(C3=CN=CC=C3)[NH+]4CCOCC4

Isomeric SMILES

CC(=O)NC1=C(C2=C(S1)CCCC2)[C@H](C3=CN=CC=C3)[NH+]4CCOCC4

InChI

InChI=1S/C20H25N3O2S/c1-14(24)22-20-18(16-6-2-3-7-17(16)26-20)19(15-5-4-8-21-13-15)23-9-11-25-12-10-23/h4-5,8,13,19H,2-3,6-7,9-12H2,1H3,(H,22,24)/p+1/t19-/m0/s1