3-cyano-N-[(2S)-1-[[4-(2-cyanophenyl)sulfonylmorpholin-2-yl]methylamino]-1-oxidanylidene-pentan-2-yl]benzamide

Systemtic Name: 3-cyano-N-[(2S)-1-[[4-(2-cyanophenyl)sulfonylmorpholin-2-yl]methylamino]-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: 3-cyano-N-[(1S)-1-[[4-(2-cyanophenyl)sulfonylmorpholin-2-yl]methylcarbamoyl]butyl]benzamide CAS Name: 3-cyano-N-[(2S)-1-[[4-(2-cyanophenyl)sulfonyl-2-morpholinyl]methylamino]-1-oxopentan-2-yl]benzamide IUPAC Name: 3-cyano-N-[(2S)-1-[[4-(2-cyanophenyl)sulfonylmorpholin-2-yl]methylamino]-1-oxopentan-2-yl]benzamide Traditional Name: 3-cyano-N-[(1S)-1-[[4-(2-cyanophenyl)sulfonylmorpholin-2-yl]methylcarbamoyl]butyl]benzamide Formula: C25H27N5O5S MolecularWeight: 509.57738

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NCC1CN(CCO1)S(=O)(=O)C2=CC=CC=C2C#N)NC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CCC[C@@H](C(=O)NCC1CN(CCO1)S(=O)(=O)C2=CC=CC=C2C#N)NC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C25H27N5O5S/c1-2-6-22(29-24(31)19-9-5-7-18(13-19)14-26)25(32)28-16-21-17-30(11-12-35-21)36(33,34)23-10-4-3-8-20(23)15-27/h3-5,7-10,13,21-22H,2,6,11-12,16-17H2,1H3,(H,28,32)(H,29,31)/t21?,22-/m0/s1