2-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-(2,5-dioxo-1-phenyl-pyrrolidin-3-yl)sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[(2,5-dioxo-1-phenyl-3-pyrrolidinyl)thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[(2,5-diketo-1-phenyl-pyrrolidin-3-yl)thio]-4,6-dimethyl-nicotinonitrile Formula: C18H15N3O2S MolecularWeight: 337.3956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SC2CC(=O)N(C2=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC2CC(=O)N(C2=O)C3=CC=CC=C3)C

InChI

InChI=1S/C18H15N3O2S/c1-11-8-12(2)20-17(14(11)10-19)24-15-9-16(22)21(18(15)23)13-6-4-3-5-7-13/h3-8,15H,9H2,1-2H3