4-[1-[5-(1-benzofuran-2-yl)-1,2,4-triazin-3-yl]piperidin-4-yl]thiomorpholin-4-ium

Systemtic Name: 4-[1-[5-(1-benzofuran-2-yl)-1,2,4-triazin-3-yl]piperidin-4-yl]thiomorpholin-4-ium Openeye Name: 4-[1-[5-(benzofuran-2-yl)-1,2,4-triazin-3-yl]-4-piperidyl]thiomorpholin-4-ium CAS Name: 4-[1-[5-(2-benzofuranyl)-1,2,4-triazin-3-yl]-4-piperidinyl]thiomorpholin-4-ium IUPAC Name: 4-[1-[5-(1-benzofuran-2-yl)-1,2,4-triazin-3-yl]piperidin-4-yl]thiomorpholin-4-ium Traditional Name: 4-[1-[5-(benzofuran-2-yl)-1,2,4-triazin-3-yl]-4-piperidyl]thiomorpholin-4-ium Formula: C20H24N5OS+ MolecularWeight: 382.50246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCSCC2)C3=NC(=CN=N3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CCC1[NH+]2CCSCC2)C3=NC(=CN=N3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C20H23N5OS/c1-2-4-18-15(3-1)13-19(26-18)17-14-21-23-20(22-17)25-7-5-16(6-8-25)24-9-11-27-12-10-24/h1-4,13-14,16H,5-12H2/p+1