N-[4-methyl-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[4-methyl-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]-1-phenyl-methanesulfonamide Openeye Name: N-[2-(3-isopropylsulfonylpiperazin-1-yl)-4-methyl-phenyl]-1-phenyl-methanesulfonamide CAS Name: N-[4-methyl-2-(3-propan-2-ylsulfonyl-1-piperazinyl)phenyl]-1-phenylmethanesulfonamide IUPAC Name: N-[4-methyl-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]-1-phenylmethanesulfonamide Traditional Name: N-[2-(3-isopropylsulfonylpiperazino)-4-methyl-phenyl]-1-phenyl-methanesulfonamide Formula: C21H29N3O4S2 MolecularWeight: 451.60266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2)N3CCNC(C3)S(=O)(=O)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2)N3CCNC(C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C21H29N3O4S2/c1-16(2)30(27,28)21-14-24(12-11-22-21)20-13-17(3)9-10-19(20)23-29(25,26)15-18-7-5-4-6-8-18/h4-10,13,16,21-23H,11-12,14-15H2,1-3H3