(2S)-2-(3-cyclohexyloxyquinoxalin-2-yl)-2-(phenylsulfonyl)ethanenitrile

Systemtic Name: (2S)-2-(3-cyclohexyloxyquinoxalin-2-yl)-2-(phenylsulfonyl)ethanenitrile Openeye Name: (2S)-2-(benzenesulfonyl)-2-[3-(cyclohexoxy)quinoxalin-2-yl]acetonitrile CAS Name: (2S)-2-(benzenesulfonyl)-2-(3-cyclohexyloxy-2-quinoxalinyl)acetonitrile IUPAC Name: (2S)-2-(benzenesulfonyl)-2-(3-cyclohexyloxyquinoxalin-2-yl)acetonitrile Traditional Name: (2S)-2-besyl-2-[3-(cyclohexoxy)quinoxalin-2-yl]acetonitrile Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)OC2=NC3=CC=CC=C3N=C2[C@@H](C#N)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3S/c23-15-20(29(26,27)17-11-5-2-6-12-17)21-22(28-16-9-3-1-4-10-16)25-19-14-8-7-13-18(19)24-21/h2,5-8,11-14,16,20H,1,3-4,9-10H2/t20-/m1/s1