2-azanylidene-3-(3-oxidanylidene-1-phenyl-butyl)-4-phenyl-thiolane-3-carbonitrile

Systemtic Name: 2-azanylidene-3-(3-oxidanylidene-1-phenyl-butyl)-4-phenyl-thiolane-3-carbonitrile Openeye Name: 2-imino-3-(3-oxo-1-phenyl-butyl)-4-phenyl-tetrahydrothiophene-3-carbonitrile CAS Name: 2-imino-3-(3-oxo-1-phenylbutyl)-4-phenyl-3-thiolanecarbonitrile IUPAC Name: 2-imino-3-(3-oxo-1-phenylbutyl)-4-phenylthiolane-3-carbonitrile Traditional Name: 2-imino-3-(3-keto-1-phenyl-butyl)-4-phenyl-tetrahydrothiophene-3-carbonitrile Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1=CC=CC=C1)C2(C(CSC2=N)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(=O)CC(C1=CC=CC=C1)C2(C(CSC2=N)C3=CC=CC=C3)C#N

InChI

InChI=1S/C21H20N2OS/c1-15(24)12-18(16-8-4-2-5-9-16)21(14-22)19(13-25-20(21)23)17-10-6-3-7-11-17/h2-11,18-19,23H,12-13H2,1H3