N-(3-methylphenyl)-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(3-methylphenyl)-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(4-methylsulfanylphenyl)methylsulfanyl]-N-(m-tolyl)-1,3,4-thiadiazol-2-amine CAS Name: N-(3-methylphenyl)-5-[[4-(methylthio)phenyl]methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-methylphenyl)-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[[4-(methylthio)benzyl]thio]-1,3,4-thiadiazol-2-yl]-(m-tolyl)amine Formula: C17H17N3S3 MolecularWeight: 359.53198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC3=CC=C(C=C3)SC

InChI

InChI=1S/C17H17N3S3/c1-12-4-3-5-14(10-12)18-16-19-20-17(23-16)22-11-13-6-8-15(21-2)9-7-13/h3-10H,11H2,1-2H3,(H,18,19)