2-[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone CAS Name: 2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]-1-(4-methylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[ethyl-(3-fluoro-4-methoxy-benzyl)amino]-1-(4-mesylpiperazino)ethanone Formula: C17H26FN3O4S MolecularWeight: 387.469443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)CC(=O)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)CC(=O)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C17H26FN3O4S/c1-4-19(12-14-5-6-16(25-2)15(18)11-14)13-17(22)20-7-9-21(10-8-20)26(3,23)24/h5-6,11H,4,7-10,12-13H2,1-3H3