2-tert-butyl-N-[[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]methyl]aniline

Systemtic Name: 2-tert-butyl-N-[[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]methyl]aniline Openeye Name: N-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)methyl]-2-tert-butyl-aniline CAS Name: 2-tert-butyl-N-[[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]methyl]aniline IUPAC Name: N-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)methyl]-2-tert-butylaniline Traditional Name: [5-(benzylthio)-1,3,4-thiadiazol-2-yl]methyl-(2-tert-butylphenyl)amine Formula: C20H23N3S2 MolecularWeight: 369.54672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NCC2=NN=C(S2)SCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NCC2=NN=C(S2)SCC3=CC=CC=C3

InChI

InChI=1S/C20H23N3S2/c1-20(2,3)16-11-7-8-12-17(16)21-13-18-22-23-19(25-18)24-14-15-9-5-4-6-10-15/h4-12,21H,13-14H2,1-3H3