N-[1-[4-(4-methylpiperidin-1-yl)phenyl]ethyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[1-[4-(4-methylpiperidin-1-yl)phenyl]ethyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[1-[4-(4-methyl-1-piperidyl)phenyl]ethyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-[1-[4-(4-methyl-1-piperidinyl)phenyl]ethyl]-3-[(4-methylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[1-[4-(4-methylpiperidin-1-yl)phenyl]ethyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: 3-[(4-mesylpiperazino)methyl]-N-[1-[4-(4-methylpiperidino)phenyl]ethyl]benzamide Formula: C27H38N4O3S MolecularWeight: 498.68062

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)C(C)NC(=O)C3=CC(=CC=C3)CN4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)C(C)NC(=O)C3=CC(=CC=C3)CN4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C27H38N4O3S/c1-21-11-13-30(14-12-21)26-9-7-24(8-10-26)22(2)28-27(32)25-6-4-5-23(19-25)20-29-15-17-31(18-16-29)35(3,33)34/h4-10,19,21-22H,11-18,20H2,1-3H3,(H,28,32)