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

Systemtic Name: 2-[1-(4-ethoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-6-propan-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[1-(4-ethoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-6-isopropyl-pyridine-3-carbonitrile CAS Name: 2-[[1-(4-ethoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]-6-propan-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-6-propan-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(2,5-diketo-1-p-phenetyl-pyrrolidin-3-yl)thio]-6-isopropyl-nicotinonitrile Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=C(C=CC(=N3)C(C)C)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=C(C=CC(=N3)C(C)C)C#N

InChI

InChI=1S/C21H21N3O3S/c1-4-27-16-8-6-15(7-9-16)24-19(25)11-18(21(24)26)28-20-14(12-22)5-10-17(23-20)13(2)3/h5-10,13,18H,4,11H2,1-3H3