5-(4-methylsulfanylphenyl)-N-naphthalen-1-yl-4-phenyl-1,3,4-thiadiazol-4-ium-2-amine

Systemtic Name: 5-(4-methylsulfanylphenyl)-N-naphthalen-1-yl-4-phenyl-1,3,4-thiadiazol-4-ium-2-amine Openeye Name: 5-(4-methylsulfanylphenyl)-N-(1-naphthyl)-4-phenyl-1,3,4-thiadiazol-4-ium-2-amine CAS Name: 5-[4-(methylthio)phenyl]-N-(1-naphthalenyl)-4-phenyl-1,3,4-thiadiazol-4-ium-2-amine IUPAC Name: 5-(4-methylsulfanylphenyl)-N-naphthalen-1-yl-4-phenyl-1,3,4-thiadiazol-4-ium-2-amine Traditional Name: [5-[4-(methylthio)phenyl]-4-phenyl-1,3,4-thiadiazol-4-ium-2-yl]-(1-naphthyl)amine Formula: C25H20N3S2+ MolecularWeight: 426.5764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=[N+](N=C(S2)NC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CSC1=CC=C(C=C1)C2=[N+](N=C(S2)NC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H20N3S2/c1-29-21-16-14-19(15-17-21)24-28(20-10-3-2-4-11-20)27-25(30-24)26-23-13-7-9-18-8-5-6-12-22(18)23/h2-17H,1H3,(H,26,27)/q+1