N-methyl-N-[(3-phenethyl-2-propan-2-ylsulfonyl-imidazol-4-yl)methyl]-1-(1H-pyrazol-5-yl)methanamine

Systemtic Name: N-methyl-N-[(3-phenethyl-2-propan-2-ylsulfonyl-imidazol-4-yl)methyl]-1-(1H-pyrazol-5-yl)methanamine Openeye Name: N-[(2-isopropylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-N-methyl-1-(1H-pyrazol-5-yl)methanamine CAS Name: N-methyl-N-[(3-phenethyl-2-propan-2-ylsulfonyl-4-imidazolyl)methyl]-1-(1H-pyrazol-5-yl)methanamine IUPAC Name: N-methyl-N-[(3-phenethyl-2-propan-2-ylsulfonylimidazol-4-yl)methyl]-1-(1H-pyrazol-5-yl)methanamine Traditional Name: (2-isopropylsulfonyl-3-phenethyl-imidazol-4-yl)methyl-methyl-(1H-pyrazol-5-ylmethyl)amine Formula: C20H27N5O2S MolecularWeight: 401.52568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)CN(C)CC3=CC=NN3

Isomeric SMILES

CC(C)S(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)CN(C)CC3=CC=NN3

InChI

InChI=1S/C20H27N5O2S/c1-16(2)28(26,27)20-21-13-19(15-24(3)14-18-9-11-22-23-18)25(20)12-10-17-7-5-4-6-8-17/h4-9,11,13,16H,10,12,14-15H2,1-3H3,(H,22,23)