N-[2-(3-methoxypiperazin-1-yl)-4-propan-2-ylsulfonyl-phenyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[2-(3-methoxypiperazin-1-yl)-4-propan-2-ylsulfonyl-phenyl]-1-phenyl-methanesulfonamide Openeye Name: N-[4-isopropylsulfonyl-2-(3-methoxypiperazin-1-yl)phenyl]-1-phenyl-methanesulfonamide CAS Name: N-[2-(3-methoxy-1-piperazinyl)-4-propan-2-ylsulfonylphenyl]-1-phenylmethanesulfonamide IUPAC Name: N-[2-(3-methoxypiperazin-1-yl)-4-propan-2-ylsulfonylphenyl]-1-phenylmethanesulfonamide Traditional Name: N-[4-isopropylsulfonyl-2-(3-methoxypiperazino)phenyl]-1-phenyl-methanesulfonamide Formula: C21H29N3O5S2 MolecularWeight: 467.60206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2)N3CCNC(C3)OC

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2)N3CCNC(C3)OC

InChI

InChI=1S/C21H29N3O5S2/c1-16(2)31(27,28)18-9-10-19(20(13-18)24-12-11-22-21(14-24)29-3)23-30(25,26)15-17-7-5-4-6-8-17/h4-10,13,16,21-23H,11-12,14-15H2,1-3H3