2-[1-(1H-indol-6-yl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-6-(2-methylpropyl)pyridine-3-carbonitrile

Systemtic Name: 2-[1-(1H-indol-6-yl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-6-(2-methylpropyl)pyridine-3-carbonitrile Openeye Name: 2-[1-(1H-indol-6-yl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-6-isobutyl-pyridine-3-carbonitrile CAS Name: 2-[[1-(1H-indol-6-yl)-2,5-dioxo-3-pyrrolidinyl]thio]-6-(2-methylpropyl)-3-pyridinecarbonitrile IUPAC Name: 2-[1-(1H-indol-6-yl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-6-(2-methylpropyl)pyridine-3-carbonitrile Traditional Name: 2-[[1-(1H-indol-6-yl)-2,5-diketo-pyrrolidin-3-yl]thio]-6-isobutyl-nicotinonitrile Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC(=C(C=C1)C#N)SC2CC(=O)N(C2=O)C3=CC4=C(C=C3)C=CN4

Isomeric SMILES

CC(C)CC1=NC(=C(C=C1)C#N)SC2CC(=O)N(C2=O)C3=CC4=C(C=C3)C=CN4

InChI

InChI=1S/C22H20N4O2S/c1-13(2)9-16-5-3-15(12-23)21(25-16)29-19-11-20(27)26(22(19)28)17-6-4-14-7-8-24-18(14)10-17/h3-8,10,13,19,24H,9,11H2,1-2H3