N-[4-[3-(1-cyano-2,2-diisocyano-ethenyl)pyrrol-1-yl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[3-(1-cyano-2,2-diisocyano-ethenyl)pyrrol-1-yl]phenyl]methanesulfonamide Openeye Name: N-[4-[3-(1-cyano-2,2-diisocyano-vinyl)pyrrol-1-yl]phenyl]methanesulfonamide CAS Name: N-[4-[3-(1-cyano-2,2-diisocyanoethenyl)-1-pyrrolyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[3-(1-cyano-2,2-diisocyanoethenyl)pyrrol-1-yl]phenyl]methanesulfonamide Traditional Name: N-[4-[3-(1-cyano-2,2-diisocyano-vinyl)pyrrol-1-yl]phenyl]methanesulfonamide Formula: C16H11N5O2S MolecularWeight: 337.35584

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)N2C=CC(=C2)C(=C([N+]#[C-])[N+]#[C-])C#N

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)N2C=CC(=C2)C(=C([N+]#[C-])[N+]#[C-])C#N

InChI

InChI=1S/C16H11N5O2S/c1-18-16(19-2)15(10-17)12-8-9-21(11-12)14-6-4-13(5-7-14)20-24(3,22)23/h4-9,11,20H,3H3