N,N-dimethyl-4-[5-(4-methylsulfinylphenyl)-3-pyrrolidin-1-yl-1,2,4-triazin-6-yl]aniline

Systemtic Name: N,N-dimethyl-4-[5-(4-methylsulfinylphenyl)-3-pyrrolidin-1-yl-1,2,4-triazin-6-yl]aniline Openeye Name: N,N-dimethyl-4-[5-(4-methylsulfinylphenyl)-3-pyrrolidin-1-yl-1,2,4-triazin-6-yl]aniline CAS Name: N,N-dimethyl-4-[5-(4-methylsulfinylphenyl)-3-(1-pyrrolidinyl)-1,2,4-triazin-6-yl]aniline IUPAC Name: N,N-dimethyl-4-[5-(4-methylsulfinylphenyl)-3-pyrrolidin-1-yl-1,2,4-triazin-6-yl]aniline Traditional Name: dimethyl-[4-[5-(4-methylsulfinylphenyl)-3-pyrrolidino-1,2,4-triazin-6-yl]phenyl]amine Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=C(N=C(N=N2)N3CCCC3)C4=CC=C(C=C4)S(=O)C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=C(N=C(N=N2)N3CCCC3)C4=CC=C(C=C4)S(=O)C

InChI

InChI=1S/C22H25N5OS/c1-26(2)18-10-6-17(7-11-18)21-20(16-8-12-19(13-9-16)29(3)28)23-22(25-24-21)27-14-4-5-15-27/h6-13H,4-5,14-15H2,1-3H3