5-(naphthalen-1-ylmethylsulfanyl)-N-(4-phenoxyphenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(naphthalen-1-ylmethylsulfanyl)-N-(4-phenoxyphenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(1-naphthylmethylsulfanyl)-N-(4-phenoxyphenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-(1-naphthalenylmethylthio)-N-(4-phenoxyphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(naphthalen-1-ylmethylsulfanyl)-N-(4-phenoxyphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]-(4-phenoxyphenyl)amine Formula: C25H19N3OS2 MolecularWeight: 441.56786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=NN=C(S3)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=NN=C(S3)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H19N3OS2/c1-2-10-21(11-3-1)29-22-15-13-20(14-16-22)26-24-27-28-25(31-24)30-17-19-9-6-8-18-7-4-5-12-23(18)19/h1-16H,17H2,(H,26,27)