6-butylsulfanyl-2-oxidanylidene-4-(4-phenylmethoxyphenyl)-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: 6-butylsulfanyl-2-oxidanylidene-4-(4-phenylmethoxyphenyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 4-(4-benzyloxyphenyl)-6-butylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 6-(butylthio)-2-oxo-4-(4-phenylmethoxyphenyl)-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 6-butylsulfanyl-2-oxo-4-(4-phenylmethoxyphenyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 4-(4-benzoxyphenyl)-6-(butylthio)-2-keto-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C23H24N2O2S MolecularWeight: 392.51386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C(CC(=O)N1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C#N

Isomeric SMILES

CCCCSC1=C(C(CC(=O)N1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C#N

InChI

InChI=1S/C23H24N2O2S/c1-2-3-13-28-23-21(15-24)20(14-22(26)25-23)18-9-11-19(12-10-18)27-16-17-7-5-4-6-8-17/h4-12,20H,2-3,13-14,16H2,1H3,(H,25,26)