N-[3-methoxy-4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-N-methylsulfonyl-methanesulfonamide

Systemtic Name: N-[3-methoxy-4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-N-methylsulfonyl-methanesulfonamide Openeye Name: N-[3-methoxy-4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-N-methylsulfonyl-methanesulfonamide CAS Name: N-[3-methoxy-4-[3-(4-phenyl-1-piperazinyl)propoxy]phenyl]-N-methylsulfonylmethanesulfonamide IUPAC Name: N-[3-methoxy-4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-N-methylsulfonylmethanesulfonamide Traditional Name: N-mesyl-N-[3-methoxy-4-[3-(4-phenylpiperazino)propoxy]phenyl]methanesulfonamide Formula: C22H31N3O6S2 MolecularWeight: 497.62804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N(S(=O)(=O)C)S(=O)(=O)C)OCCCN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)N(S(=O)(=O)C)S(=O)(=O)C)OCCCN2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H31N3O6S2/c1-30-22-18-20(25(32(2,26)27)33(3,28)29)10-11-21(22)31-17-7-12-23-13-15-24(16-14-23)19-8-5-4-6-9-19/h4-6,8-11,18H,7,12-17H2,1-3H3