(2S)-N-(3-cyanophenyl)-2-[(3-piperidin-1-ylsulfonylphenyl)amino]propanamide

Systemtic Name: (2S)-N-(3-cyanophenyl)-2-[(3-piperidin-1-ylsulfonylphenyl)amino]propanamide Openeye Name: (2S)-N-(3-cyanophenyl)-2-[3-(1-piperidylsulfonyl)anilino]propanamide CAS Name: (2S)-N-(3-cyanophenyl)-2-[3-(1-piperidinylsulfonyl)anilino]propanamide IUPAC Name: (2S)-N-(3-cyanophenyl)-2-(3-piperidin-1-ylsulfonylanilino)propanamide Traditional Name: (2S)-N-(3-cyanophenyl)-2-(3-piperidinosulfonylanilino)propionamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC(=C1)C#N)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H24N4O3S/c1-16(21(26)24-18-8-5-7-17(13-18)15-22)23-19-9-6-10-20(14-19)29(27,28)25-11-3-2-4-12-25/h5-10,13-14,16,23H,2-4,11-12H2,1H3,(H,24,26)/t16-/m0/s1