2-azanyl-4-cyclopropyl-6-[1-(4-ethoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-cyclopropyl-6-[1-(4-ethoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-cyclopropyl-6-[1-(4-ethoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-cyclopropyl-6-[[1-(4-ethoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-cyclopropyl-6-[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-cyclopropyl-6-[(2,5-diketo-1-p-phenetyl-pyrrolidin-3-yl)thio]dinicotinonitrile Formula: C22H19N5O3S MolecularWeight: 433.48296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=C(C(=C(C(=N3)N)C#N)C4CC4)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=C(C(=C(C(=N3)N)C#N)C4CC4)C#N

InChI

InChI=1S/C22H19N5O3S/c1-2-30-14-7-5-13(6-8-14)27-18(28)9-17(22(27)29)31-21-16(11-24)19(12-3-4-12)15(10-23)20(25)26-21/h5-8,12,17H,2-4,9H2,1H3,(H2,25,26)