1-[(2-methylphenyl)methyl]-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide

Systemtic Name: 1-[(2-methylphenyl)methyl]-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide Openeye Name: N-(4-morpholinosulfonylphenyl)-1-(o-tolylmethyl)piperidine-3-carboxamide CAS Name: 1-[(2-methylphenyl)methyl]-N-[4-(4-morpholinylsulfonyl)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-[(2-methylphenyl)methyl]-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide Traditional Name: 1-(2-methylbenzyl)-N-(4-morpholinosulfonylphenyl)nipecotamide Formula: C24H31N3O4S MolecularWeight: 457.58564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCCC(C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1CN2CCCC(C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C24H31N3O4S/c1-19-5-2-3-6-20(19)17-26-12-4-7-21(18-26)24(28)25-22-8-10-23(11-9-22)32(29,30)27-13-15-31-16-14-27/h2-3,5-6,8-11,21H,4,7,12-18H2,1H3,(H,25,28)