[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl]-bis(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl]-bis(thiophen-2-ylmethyl)azanium Openeye Name: [2-[4-(cyanomethyl)anilino]-2-oxo-ethyl]-bis(2-thienylmethyl)ammonium CAS Name: [2-[4-(cyanomethyl)anilino]-2-oxoethyl]-bis(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-[4-(cyanomethyl)anilino]-2-oxoethyl]-bis(thiophen-2-ylmethyl)azanium Traditional Name: [2-[4-(cyanomethyl)anilino]-2-keto-ethyl]-bis(2-thenyl)ammonium Formula: C20H20N3OS2+ MolecularWeight: 382.5223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C[NH+](CC2=CC=CS2)CC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1=CSC(=C1)C[NH+](CC2=CC=CS2)CC(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C20H19N3OS2/c21-10-9-16-5-7-17(8-6-16)22-20(24)15-23(13-18-3-1-11-25-18)14-19-4-2-12-26-19/h1-8,11-12H,9,13-15H2,(H,22,24)/p+1