1-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-[(3-bromophenyl)methylidene]-4-methyl-2,6-bis(oxidanylidene)pyridine-3-carbonitrile

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-[(3-bromophenyl)methylidene]-4-methyl-2,6-bis(oxidanylidene)pyridine-3-carbonitrile Openeye Name: 5-[(3-bromophenyl)methylene]-1-(1,1-dioxothiolan-3-yl)-4-methyl-2,6-dioxo-pyridine-3-carbonitrile CAS Name: 5-[(3-bromophenyl)methylidene]-1-(1,1-dioxo-3-thiolanyl)-4-methyl-2,6-dioxo-3-pyridinecarbonitrile IUPAC Name: 5-[(3-bromophenyl)methylidene]-1-(1,1-dioxothiolan-3-yl)-4-methyl-2,6-dioxopyridine-3-carbonitrile Traditional Name: 5-(3-bromobenzylidene)-1-(1,1-diketothiolan-3-yl)-2,6-diketo-4-methyl-nicotinonitrile Formula: C18H15BrN2O4S MolecularWeight: 435.2917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=O)C1=CC2=CC(=CC=C2)Br)C3CCS(=O)(=O)C3)C#N

Isomeric SMILES

CC1=C(C(=O)N(C(=O)C1=CC2=CC(=CC=C2)Br)C3CCS(=O)(=O)C3)C#N

InChI

InChI=1S/C18H15BrN2O4S/c1-11-15(8-12-3-2-4-13(19)7-12)17(22)21(18(23)16(11)9-20)14-5-6-26(24,25)10-14/h2-4,7-8,14H,5-6,10H2,1H3