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

Systemtic Name: 2-azanyl-6-[1-(4-bromanyl-2-chloranyl-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-4-cyclopropyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-[1-(4-bromo-2-chloro-phenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-4-cyclopropyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-[[1-(4-bromo-2-chlorophenyl)-2,5-dioxo-3-pyrrolidinyl]thio]-4-cyclopropylpyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[1-(4-bromo-2-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-4-cyclopropylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-[[1-(4-bromo-2-chloro-phenyl)-2,5-diketo-pyrrolidin-3-yl]thio]-4-cyclopropyl-dinicotinonitrile Formula: C20H13BrClN5O2S MolecularWeight: 502.77152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=NC(=C2C#N)SC3CC(=O)N(C3=O)C4=C(C=C(C=C4)Br)Cl)N)C#N

Isomeric SMILES

C1CC1C2=C(C(=NC(=C2C#N)SC3CC(=O)N(C3=O)C4=C(C=C(C=C4)Br)Cl)N)C#N

InChI

InChI=1S/C20H13BrClN5O2S/c21-10-3-4-14(13(22)5-10)27-16(28)6-15(20(27)29)30-19-12(8-24)17(9-1-2-9)11(7-23)18(25)26-19/h3-5,9,15H,1-2,6H2,(H2,25,26)