1-(8-bromanyl-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-2-thiomorpholin-4-ium-4-yl-ethanone

Systemtic Name: 1-(8-bromanyl-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-2-thiomorpholin-4-ium-4-yl-ethanone Openeye Name: 1-(8-bromo-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-2-thiomorpholin-4-ium-4-yl-ethanone CAS Name: 1-(8-bromo-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-2-(4-thiomorpholin-4-iumyl)ethanone IUPAC Name: 1-(8-bromo-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-2-thiomorpholin-4-ium-4-ylethanone Traditional Name: 1-(8-bromo-1,3,4,5-tetrahydropyrid[4,3-b]indol-2-yl)-2-thiomorpholin-4-ium-4-yl-ethanone Formula: C17H21BrN3OS+ MolecularWeight: 395.33714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1NC3=C2C=C(C=C3)Br)C(=O)C[NH+]4CCSCC4

Isomeric SMILES

C1CN(CC2=C1NC3=C2C=C(C=C3)Br)C(=O)C[NH+]4CCSCC4

InChI

InChI=1S/C17H20BrN3OS/c18-12-1-2-15-13(9-12)14-10-21(4-3-16(14)19-15)17(22)11-20-5-7-23-8-6-20/h1-2,9,19H,3-8,10-11H2/p+1