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

Systemtic Name: (3S,4R,5S)-2-azanylidene-4-(furan-2-yl)-5-(phenylcarbonyl)thiolane-3-carbonitrile Openeye Name: (3S,4R,5S)-5-benzoyl-4-(2-furyl)-2-imino-tetrahydrothiophene-3-carbonitrile CAS Name: (3S,4R,5S)-5-benzoyl-4-(2-furanyl)-2-imino-3-thiolanecarbonitrile IUPAC Name: (3S,4R,5S)-5-benzoyl-4-(furan-2-yl)-2-iminothiolane-3-carbonitrile Traditional Name: (3S,4R,5S)-5-benzoyl-4-(2-furyl)-2-imino-tetrahydrothiophene-3-carbonitrile Formula: C16H12N2O2S MolecularWeight: 296.34368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2C(C(C(=N)S2)C#N)C3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)[C@@H]2[C@H]([C@H](C(=N)S2)C#N)C3=CC=CO3

InChI

InChI=1S/C16H12N2O2S/c17-9-11-13(12-7-4-8-20-12)15(21-16(11)18)14(19)10-5-2-1-3-6-10/h1-8,11,13,15,18H/t11-,13-,15+/m1/s1