(3,5-dimethyl-4-morpholin-4-ylsulfonyl-pyrazol-1-yl)methyl-ethyl-(phenylmethyl)azanium

Systemtic Name: (3,5-dimethyl-4-morpholin-4-ylsulfonyl-pyrazol-1-yl)methyl-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[(3,5-dimethyl-4-morpholinosulfonyl-pyrazol-1-yl)methyl]-ethyl-ammonium CAS Name: [3,5-dimethyl-4-(4-morpholinylsulfonyl)-1-pyrazolyl]methyl-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(3,5-dimethyl-4-morpholin-4-ylsulfonylpyrazol-1-yl)methyl]-ethylazanium Traditional Name: benzyl-[(3,5-dimethyl-4-morpholinosulfonyl-pyrazol-1-yl)methyl]-ethyl-ammonium Formula: C19H29N4O3S+ MolecularWeight: 393.52356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CN2C(=C(C(=N2)C)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CN2C(=C(C(=N2)C)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C19H28N4O3S/c1-4-21(14-18-8-6-5-7-9-18)15-23-17(3)19(16(2)20-23)27(24,25)22-10-12-26-13-11-22/h5-9H,4,10-15H2,1-3H3/p+1