4,6-dimethyl-2-(2-oxidanyl-3-phenylazanyl-propyl)sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-(2-oxidanyl-3-phenylazanyl-propyl)sulfanyl-pyridine-3-carbonitrile Openeye Name: 2-(3-anilino-2-hydroxy-propyl)sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[(3-anilino-2-hydroxypropyl)thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-(3-anilino-2-hydroxypropyl)sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[(3-anilino-2-hydroxy-propyl)thio]-4,6-dimethyl-nicotinonitrile Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(CNC2=CC=CC=C2)O)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(CNC2=CC=CC=C2)O)C

InChI

InChI=1S/C17H19N3OS/c1-12-8-13(2)20-17(16(12)9-18)22-11-15(21)10-19-14-6-4-3-5-7-14/h3-8,15,19,21H,10-11H2,1-2H3