4,6-dimethyl-2-(3-naphthalen-1-yloxypropylsulfanyl)pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-(3-naphthalen-1-yloxypropylsulfanyl)pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-[3-(1-naphthyloxy)propylsulfanyl]pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-[3-(1-naphthalenyloxy)propylthio]-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-2-(3-naphthalen-1-yloxypropylsulfanyl)pyridine-3-carbonitrile Traditional Name: 4,6-dimethyl-2-[3-(1-naphthoxy)propylthio]nicotinonitrile Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCCCOC2=CC=CC3=CC=CC=C32)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCCCOC2=CC=CC3=CC=CC=C32)C

InChI

InChI=1S/C21H20N2OS/c1-15-13-16(2)23-21(19(15)14-22)25-12-6-11-24-20-10-5-8-17-7-3-4-9-18(17)20/h3-5,7-10,13H,6,11-12H2,1-2H3