2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[4-(4-cyanobenzyl)piperazino]-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide Formula: C25H31N5O4S MolecularWeight: 497.60974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)C#N)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)C#N)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H31N5O4S/c1-20-2-7-23(16-24(20)35(32,33)30-12-14-34-15-13-30)27-25(31)19-29-10-8-28(9-11-29)18-22-5-3-21(17-26)4-6-22/h2-7,16H,8-15,18-19H2,1H3,(H,27,31)