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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=CC=C(C=C2)C(C)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC1CCCN(C1)C2=CC=C(C=C2)C(C)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C27H38N4O3S/c1-21-5-4-14-30(19-21)26-12-10-24(11-13-26)22(2)28-27(32)25-8-6-23(7-9-25)20-29-15-17-31(18-16-29)35(3,33)34/h6-13,21-22H,4-5,14-20H2,1-3H3,(H,28,32)