2-[[1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-phenylazanyl-methylidene]propanedinitrile

Systemtic Name: 2-[[1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-phenylazanyl-methylidene]propanedinitrile Openeye Name: 2-[anilino-[2,5-dioxo-1-(p-tolyl)pyrrolidin-3-yl]sulfanyl-methylene]propanedinitrile CAS Name: 2-[anilino-[[1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]methylidene]propanedinitrile IUPAC Name: 2-[anilino-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylmethylidene]propanedinitrile Traditional Name: 2-[anilino-[[2,5-diketo-1-(p-tolyl)pyrrolidin-3-yl]thio]methylene]malononitrile Formula: C21H16N4O2S MolecularWeight: 388.44234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC(=C(C#N)C#N)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC(=C(C#N)C#N)NC3=CC=CC=C3

InChI

InChI=1S/C21H16N4O2S/c1-14-7-9-17(10-8-14)25-19(26)11-18(21(25)27)28-20(15(12-22)13-23)24-16-5-3-2-4-6-16/h2-10,18,24H,11H2,1H3