N-[4-[2-[4-(4-azanylpyridin-3-yl)piperazin-1-yl]ethanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[2-[4-(4-azanylpyridin-3-yl)piperazin-1-yl]ethanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[2-[4-(4-amino-3-pyridyl)piperazin-1-yl]acetyl]phenyl]methanesulfonamide CAS Name: N-[4-[2-[4-(4-amino-3-pyridinyl)-1-piperazinyl]-1-oxoethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-[4-(4-aminopyridin-3-yl)piperazin-1-yl]acetyl]phenyl]methanesulfonamide Traditional Name: N-[4-[2-[4-(4-amino-3-pyridyl)piperazino]acetyl]phenyl]methanesulfonamide Formula: C18H23N5O3S MolecularWeight: 389.47192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)CN2CCN(CC2)C3=C(C=CN=C3)N

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)CN2CCN(CC2)C3=C(C=CN=C3)N

InChI

InChI=1S/C18H23N5O3S/c1-27(25,26)21-15-4-2-14(3-5-15)18(24)13-22-8-10-23(11-9-22)17-12-20-7-6-16(17)19/h2-7,12,21H,8-11,13H2,1H3,(H2,19,20)