N-[[5-(2-dimethylaminoethylsulfanyl)-4-ethyl-1,2,4-triazol-3-yl]methyl]aniline

Systemtic Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-ethyl-1,2,4-triazol-3-yl]methyl]aniline Openeye Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-ethyl-1,2,4-triazol-3-yl]methyl]aniline CAS Name: N-[[5-(2-dimethylaminoethylthio)-4-ethyl-1,2,4-triazol-3-yl]methyl]aniline IUPAC Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-ethyl-1,2,4-triazol-3-yl]methyl]aniline Traditional Name: 2-[[5-(anilinomethyl)-4-ethyl-1,2,4-triazol-3-yl]thio]ethyl-dimethyl-amine Formula: C15H23N5S MolecularWeight: 305.44162

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCN(C)C)CNC2=CC=CC=C2

Isomeric SMILES

CCN1C(=NN=C1SCCN(C)C)CNC2=CC=CC=C2

InChI

InChI=1S/C15H23N5S/c1-4-20-14(12-16-13-8-6-5-7-9-13)17-18-15(20)21-11-10-19(2)3/h5-9,16H,4,10-12H2,1-3H3