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

Systemtic Name: 2-azanyl-4-cyclopropyl-6-[1-(4-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-cyclopropyl-6-[1-(4-methoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-cyclopropyl-6-[[1-(4-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-cyclopropyl-6-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-cyclopropyl-6-[[2,5-diketo-1-(4-methoxyphenyl)pyrrolidin-3-yl]thio]dinicotinonitrile Formula: C21H17N5O3S MolecularWeight: 419.45638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=C(C(=C(C(=N3)N)C#N)C4CC4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=C(C(=C(C(=N3)N)C#N)C4CC4)C#N

InChI

InChI=1S/C21H17N5O3S/c1-29-13-6-4-12(5-7-13)26-17(27)8-16(21(26)28)30-20-15(10-23)18(11-2-3-11)14(9-22)19(24)25-20/h4-7,11,16H,2-3,8H2,1H3,(H2,24,25)