N-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-N-methyl-1-quinolin-5-yl-methanamine

Systemtic Name: N-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-N-methyl-1-quinolin-5-yl-methanamine Openeye Name: N-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-N-methyl-1-(5-quinolyl)methanamine CAS Name: N-[(3-butyl-2-ethylsulfonyl-4-imidazolyl)methyl]-N-methyl-1-(5-quinolinyl)methanamine IUPAC Name: N-[(3-butyl-2-ethylsulfonylimidazol-4-yl)methyl]-N-methyl-1-quinolin-5-ylmethanamine Traditional Name: (3-butyl-2-esyl-imidazol-4-yl)methyl-methyl-(5-quinolylmethyl)amine Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC)CN(C)CC2=C3C=CC=NC3=CC=C2

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC)CN(C)CC2=C3C=CC=NC3=CC=C2

InChI

InChI=1S/C21H28N4O2S/c1-4-6-13-25-18(14-23-21(25)28(26,27)5-2)16-24(3)15-17-9-7-11-20-19(17)10-8-12-22-20/h7-12,14H,4-6,13,15-16H2,1-3H3