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

Systemtic Name: 2-tert-butyl-N-[(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)methyl]aniline Openeye Name: N-[(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)methyl]-2-tert-butyl-aniline CAS Name: 2-tert-butyl-N-[[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]methyl]aniline IUPAC Name: 2-tert-butyl-N-[(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)methyl]aniline Traditional Name: [5-(allylthio)-1,3,4-thiadiazol-2-yl]methyl-(2-tert-butylphenyl)amine Formula: C16H21N3S2 MolecularWeight: 319.48804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NCC2=NN=C(S2)SCC=C

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NCC2=NN=C(S2)SCC=C

InChI

InChI=1S/C16H21N3S2/c1-5-10-20-15-19-18-14(21-15)11-17-13-9-7-6-8-12(13)16(2,3)4/h5-9,17H,1,10-11H2,2-4H3