N-[(2S)-1-[[4-(2-cyanophenyl)sulfonylmorpholin-2-yl]methylamino]-1-oxidanylidene-4-phenyl-butan-2-yl]benzamide

Systemtic Name: N-[(2S)-1-[[4-(2-cyanophenyl)sulfonylmorpholin-2-yl]methylamino]-1-oxidanylidene-4-phenyl-butan-2-yl]benzamide Openeye Name: N-[(1S)-1-[[4-(2-cyanophenyl)sulfonylmorpholin-2-yl]methylcarbamoyl]-3-phenyl-propyl]benzamide CAS Name: N-[(2S)-1-[[4-(2-cyanophenyl)sulfonyl-2-morpholinyl]methylamino]-1-oxo-4-phenylbutan-2-yl]benzamide IUPAC Name: N-[(2S)-1-[[4-(2-cyanophenyl)sulfonylmorpholin-2-yl]methylamino]-1-oxo-4-phenylbutan-2-yl]benzamide Traditional Name: N-[(1S)-1-[[4-(2-cyanophenyl)sulfonylmorpholin-2-yl]methylcarbamoyl]-3-phenyl-propyl]benzamide Formula: C29H30N4O5S MolecularWeight: 546.6373

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1S(=O)(=O)C2=CC=CC=C2C#N)CNC(=O)C(CCC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1COC(CN1S(=O)(=O)C2=CC=CC=C2C#N)CNC(=O)[C@H](CCC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H30N4O5S/c30-19-24-13-7-8-14-27(24)39(36,37)33-17-18-38-25(21-33)20-31-29(35)26(16-15-22-9-3-1-4-10-22)32-28(34)23-11-5-2-6-12-23/h1-14,25-26H,15-18,20-21H2,(H,31,35)(H,32,34)/t25?,26-/m0/s1