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

Systemtic Name: 2-[2,5-bis(oxidanylidene)-1-(4-phenoxyphenyl)pyrrolidin-3-yl]sulfanyl-6-cyclopropyl-pyridine-3-carbonitrile Openeye Name: 6-cyclopropyl-2-[2,5-dioxo-1-(4-phenoxyphenyl)pyrrolidin-3-yl]sulfanyl-pyridine-3-carbonitrile CAS Name: 6-cyclopropyl-2-[[2,5-dioxo-1-(4-phenoxyphenyl)-3-pyrrolidinyl]thio]-3-pyridinecarbonitrile IUPAC Name: 6-cyclopropyl-2-[2,5-dioxo-1-(4-phenoxyphenyl)pyrrolidin-3-yl]sulfanylpyridine-3-carbonitrile Traditional Name: 6-cyclopropyl-2-[[2,5-diketo-1-(4-phenoxyphenyl)pyrrolidin-3-yl]thio]nicotinonitrile Formula: C25H19N3O3S MolecularWeight: 441.50166

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(C=C2)C#N)SC3CC(=O)N(C3=O)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NC(=C(C=C2)C#N)SC3CC(=O)N(C3=O)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H19N3O3S/c26-15-17-8-13-21(16-6-7-16)27-24(17)32-22-14-23(29)28(25(22)30)18-9-11-20(12-10-18)31-19-4-2-1-3-5-19/h1-5,8-13,16,22H,6-7,14H2