3-[[(4-cyanophenyl)carbamothioylamino]-phenyl-methyl]benzenediazonium

Systemtic Name: 3-[[(4-cyanophenyl)carbamothioylamino]-phenyl-methyl]benzenediazonium Openeye Name: 3-[[(4-cyanophenyl)carbamothioylamino]-phenyl-methyl]benzenediazonium CAS Name: 3-[[[(4-cyanoanilino)-sulfanylidenemethyl]amino]-phenylmethyl]benzenediazonium IUPAC Name: 3-[[(4-cyanophenyl)carbamothioylamino]-phenylmethyl]benzenediazonium Traditional Name: 3-[[(4-cyanophenyl)thiocarbamoylamino]-phenyl-methyl]benzenediazonium Formula: C21H16N5S+ MolecularWeight: 370.45024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC(=CC=C2)[N+]#N)NC(=S)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC(=CC=C2)[N+]#N)NC(=S)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H15N5S/c22-14-15-9-11-18(12-10-15)24-21(27)25-20(16-5-2-1-3-6-16)17-7-4-8-19(13-17)26-23/h1-13,20H,(H-,24,25,27)/p+1