N-[3-(diethylcarbamoyl)phenyl]-1-naphthalen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(diethylcarbamoyl)phenyl]-1-naphthalen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(diethylcarbamoyl)phenyl]-1-(2-naphthylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-[diethylamino(oxo)methyl]phenyl]-1-(2-naphthalenylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[3-(diethylcarbamoyl)phenyl]-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(diethylcarbamoyl)phenyl]-1-(2-naphthylsulfonyl)isonipecotamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H31N3O4S/c1-3-29(4-2)27(32)23-10-7-11-24(18-23)28-26(31)21-14-16-30(17-15-21)35(33,34)25-13-12-20-8-5-6-9-22(20)19-25/h5-13,18-19,21H,3-4,14-17H2,1-2H3,(H,28,31)