N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]benzamide CAS Name: N-[4-(4-methylsulfonyl-1-piperazinyl)phenyl]-4-propan-2-ylbenzamide IUPAC Name: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-4-propan-2-ylbenzamide Traditional Name: 4-isopropyl-N-[4-(4-mesylpiperazino)phenyl]benzamide Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C21H27N3O3S/c1-16(2)17-4-6-18(7-5-17)21(25)22-19-8-10-20(11-9-19)23-12-14-24(15-13-23)28(3,26)27/h4-11,16H,12-15H2,1-3H3,(H,22,25)