4-[3-(3-cyanophenyl)-2-(naphthalen-2-ylsulfonylamino)propanoyl]-N,N-diethyl-piperazine-1-carboxamide

Systemtic Name: 4-[3-(3-cyanophenyl)-2-(naphthalen-2-ylsulfonylamino)propanoyl]-N,N-diethyl-piperazine-1-carboxamide Openeye Name: 4-[3-(3-cyanophenyl)-2-(2-naphthylsulfonylamino)propanoyl]-N,N-diethyl-piperazine-1-carboxamide CAS Name: 4-[3-(3-cyanophenyl)-2-(2-naphthalenylsulfonylamino)-1-oxopropyl]-N,N-diethyl-1-piperazinecarboxamide IUPAC Name: 4-[3-(3-cyanophenyl)-2-(naphthalen-2-ylsulfonylamino)propanoyl]-N,N-diethylpiperazine-1-carboxamide Traditional Name: 4-[3-(3-cyanophenyl)-2-(2-naphthylsulfonylamino)propanoyl]-N,N-diethyl-piperazine-1-carboxamide Formula: C29H33N5O4S MolecularWeight: 547.66842

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C#N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C#N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H33N5O4S/c1-3-32(4-2)29(36)34-16-14-33(15-17-34)28(35)27(19-22-8-7-9-23(18-22)21-30)31-39(37,38)26-13-12-24-10-5-6-11-25(24)20-26/h5-13,18,20,27,31H,3-4,14-17,19H2,1-2H3