N,N-dimethyl-4-[3-methyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-4-yl]aniline

Systemtic Name: N,N-dimethyl-4-[3-methyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-4-yl]aniline Openeye Name: N,N-dimethyl-4-[3-methyl-5-(tetrahydrofuran-2-ylmethylsulfanyl)-1,2,4-triazol-4-yl]aniline CAS Name: N,N-dimethyl-4-[3-methyl-5-(2-oxolanylmethylthio)-1,2,4-triazol-4-yl]aniline IUPAC Name: N,N-dimethyl-4-[3-methyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-4-yl]aniline Traditional Name: dimethyl-[4-[3-methyl-5-(tetrahydrofurfurylthio)-1,2,4-triazol-4-yl]phenyl]amine Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=C(C=C2)N(C)C)SCC3CCCO3

Isomeric SMILES

CC1=NN=C(N1C2=CC=C(C=C2)N(C)C)SCC3CCCO3

InChI

InChI=1S/C16H22N4OS/c1-12-17-18-16(22-11-15-5-4-10-21-15)20(12)14-8-6-13(7-9-14)19(2)3/h6-9,15H,4-5,10-11H2,1-3H3