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

Systemtic Name: N-methyl-1-(1,2-oxazol-5-yl)-N-[(3-phenethyl-2-propan-2-ylsulfonyl-imidazol-4-yl)methyl]methanamine Openeye Name: N-[(2-isopropylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-1-isoxazol-5-yl-N-methyl-methanamine CAS Name: 1-(5-isoxazolyl)-N-methyl-N-[(3-phenethyl-2-propan-2-ylsulfonyl-4-imidazolyl)methyl]methanamine IUPAC Name: N-methyl-1-(1,2-oxazol-5-yl)-N-[(3-phenethyl-2-propan-2-ylsulfonylimidazol-4-yl)methyl]methanamine Traditional Name: (2-isopropylsulfonyl-3-phenethyl-imidazol-4-yl)methyl-(isoxazol-5-ylmethyl)-methyl-amine Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)CN(C)CC3=CC=NO3

Isomeric SMILES

CC(C)S(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)CN(C)CC3=CC=NO3

InChI

InChI=1S/C20H26N4O3S/c1-16(2)28(25,26)20-21-13-18(14-23(3)15-19-9-11-22-27-19)24(20)12-10-17-7-5-4-6-8-17/h4-9,11,13,16H,10,12,14-15H2,1-3H3