N-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-N-methyl-1-pyrimidin-4-yl-methanamine

Systemtic Name: N-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-N-methyl-1-pyrimidin-4-yl-methanamine Openeye Name: N-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-N-methyl-1-pyrimidin-4-yl-methanamine CAS Name: N-[(2-ethylsulfonyl-3-phenethyl-4-imidazolyl)methyl]-N-methyl-1-(4-pyrimidinyl)methanamine IUPAC Name: N-[(2-ethylsulfonyl-3-phenethylimidazol-4-yl)methyl]-N-methyl-1-pyrimidin-4-ylmethanamine Traditional Name: (2-esyl-3-phenethyl-imidazol-4-yl)methyl-methyl-(4-pyrimidylmethyl)amine Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)CN(C)CC3=NC=NC=C3

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)CN(C)CC3=NC=NC=C3

InChI

InChI=1S/C20H25N5O2S/c1-3-28(26,27)20-22-13-19(15-24(2)14-18-9-11-21-16-23-18)25(20)12-10-17-7-5-4-6-8-17/h4-9,11,13,16H,3,10,12,14-15H2,1-2H3