(2S)-N-(3-cyanophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-phenyl-propanamide

Systemtic Name: (2S)-N-(3-cyanophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-phenyl-propanamide Openeye Name: (2S)-N-(3-cyanophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-phenyl-propanamide CAS Name: (2S)-N-(3-cyanophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-phenylpropanamide IUPAC Name: (2S)-N-(3-cyanophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-phenylpropanamide Traditional Name: (2S)-N-(3-cyanophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-phenyl-propionamide Formula: C24H21N3O5S MolecularWeight: 463.50564

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)N[C@@H](CC3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C24H21N3O5S/c25-16-18-7-4-8-19(13-18)26-24(28)21(14-17-5-2-1-3-6-17)27-33(29,30)20-9-10-22-23(15-20)32-12-11-31-22/h1-10,13,15,21,27H,11-12,14H2,(H,26,28)/t21-/m0/s1