(3R,4S)-3-nitro-2-oxidanyl-2,4-diphenyl-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: (3R,4S)-3-nitro-2-oxidanyl-2,4-diphenyl-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: (3R,4S)-2-hydroxy-3-nitro-2,4-diphenyl-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: (3R,4S)-2-hydroxy-6-mercapto-3-nitro-2,4-diphenyl-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: (3R,4S)-2-hydroxy-3-nitro-2,4-diphenyl-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: (3R,4S)-2-hydroxy-6-mercapto-3-nitro-2,4-diphenyl-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(C(NC(=C2C#N)S)(C3=CC=CC=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2[C@H](C(NC(=C2C#N)S)(C3=CC=CC=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O3S/c19-11-14-15(12-7-3-1-4-8-12)16(21(23)24)18(22,20-17(14)25)13-9-5-2-6-10-13/h1-10,15-16,20,22,25H/t15-,16+,18?/m0/s1