(4R,5S)-2-azanylidene-4-(2-methylphenyl)-5-(phenylcarbonyl)thiolane-3-carbonitrile

Systemtic Name: (4R,5S)-2-azanylidene-4-(2-methylphenyl)-5-(phenylcarbonyl)thiolane-3-carbonitrile Openeye Name: (4R,5S)-5-benzoyl-2-imino-4-(o-tolyl)tetrahydrothiophene-3-carbonitrile CAS Name: (4R,5S)-5-benzoyl-2-imino-4-(2-methylphenyl)-3-thiolanecarbonitrile IUPAC Name: (4R,5S)-5-benzoyl-2-imino-4-(2-methylphenyl)thiolane-3-carbonitrile Traditional Name: (4R,5S)-5-benzoyl-2-imino-4-(o-tolyl)tetrahydrothiophene-3-carbonitrile Formula: C19H16N2OS MolecularWeight: 320.40814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(C(=N)SC2C(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

CC1=CC=CC=C1[C@@H]2[C@H](SC(=N)C2C#N)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H16N2OS/c1-12-7-5-6-10-14(12)16-15(11-20)19(21)23-18(16)17(22)13-8-3-2-4-9-13/h2-10,15-16,18,21H,1H3/t15?,16-,18-/m0/s1