(2Z)-2-[(4R,5S)-4-methyl-5-piperidin-1-yl-1,3-oxazolidin-2-ylidene]-2-(phenylsulfonyl)ethanenitrile

Systemtic Name: (2Z)-2-[(4R,5S)-4-methyl-5-piperidin-1-yl-1,3-oxazolidin-2-ylidene]-2-(phenylsulfonyl)ethanenitrile Openeye Name: (2Z)-2-(benzenesulfonyl)-2-[(4R,5S)-4-methyl-5-(1-piperidyl)oxazolidin-2-ylidene]acetonitrile CAS Name: (2Z)-2-(benzenesulfonyl)-2-[(4R,5S)-4-methyl-5-(1-piperidinyl)-2-oxazolidinylidene]acetonitrile IUPAC Name: (2Z)-2-(benzenesulfonyl)-2-[(4R,5S)-4-methyl-5-piperidin-1-yl-1,3-oxazolidin-2-ylidene]acetonitrile Traditional Name: (2Z)-2-besyl-2-[(4R,5S)-4-methyl-5-piperidino-oxazolidin-2-ylidene]acetonitrile Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(=C(C#N)S(=O)(=O)C2=CC=CC=C2)N1)N3CCCCC3

Isomeric SMILES

C[C@@H]1[C@H](O/C(=C(/C#N)\S(=O)(=O)C2=CC=CC=C2)/N1)N3CCCCC3

InChI

InChI=1S/C17H21N3O3S/c1-13-17(20-10-6-3-7-11-20)23-16(19-13)15(12-18)24(21,22)14-8-4-2-5-9-14/h2,4-5,8-9,13,17,19H,3,6-7,10-11H2,1H3/b16-15-/t13-,17+/m1/s1