2-(2-morpholin-4-ium-4-ylethylsulfanyl)-6-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-(2-morpholin-4-ium-4-ylethylsulfanyl)-6-phenyl-pyridine-3-carbonitrile Openeye Name: 2-(2-morpholin-4-ium-4-ylethylsulfanyl)-6-phenyl-pyridine-3-carbonitrile CAS Name: 2-[2-(4-morpholin-4-iumyl)ethylthio]-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-(2-morpholin-4-ium-4-ylethylsulfanyl)-6-phenylpyridine-3-carbonitrile Traditional Name: 2-(2-morpholin-4-ium-4-ylethylthio)-6-phenyl-nicotinonitrile Formula: C18H20N3OS+ MolecularWeight: 326.4359

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCSC2=C(C=CC(=N2)C3=CC=CC=C3)C#N

Isomeric SMILES

C1COCC[NH+]1CCSC2=C(C=CC(=N2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C18H19N3OS/c19-14-16-6-7-17(15-4-2-1-3-5-15)20-18(16)23-13-10-21-8-11-22-12-9-21/h1-7H,8-13H2/p+1