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

Systemtic Name: N-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-1-isoquinolin-5-yl-N-methyl-methanamine Openeye Name: N-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-1-(5-isoquinolyl)-N-methyl-methanamine CAS Name: N-[[2-ethylsulfonyl-3-(2-methoxyethyl)-4-imidazolyl]methyl]-1-(5-isoquinolinyl)-N-methylmethanamine IUPAC Name: N-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-1-isoquinolin-5-yl-N-methylmethanamine Traditional Name: [2-esyl-3-(2-methoxyethyl)imidazol-4-yl]methyl-(5-isoquinolylmethyl)-methyl-amine Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCOC)CN(C)CC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCOC)CN(C)CC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C20H26N4O3S/c1-4-28(25,26)20-22-13-18(24(20)10-11-27-3)15-23(2)14-17-7-5-6-16-12-21-9-8-19(16)17/h5-9,12-13H,4,10-11,14-15H2,1-3H3