2-methylsulfanyl-1-(3-morpholin-4-ylpropyl)-5-oxidanylidene-4,4-diphenyl-pyrrole-3-carbonitrile

Systemtic Name: 2-methylsulfanyl-1-(3-morpholin-4-ylpropyl)-5-oxidanylidene-4,4-diphenyl-pyrrole-3-carbonitrile Openeye Name: 2-methylsulfanyl-1-(3-morpholinopropyl)-5-oxo-4,4-diphenyl-pyrrole-3-carbonitrile CAS Name: 2-(methylthio)-1-[3-(4-morpholinyl)propyl]-5-oxo-4,4-diphenyl-3-pyrrolecarbonitrile IUPAC Name: 2-methylsulfanyl-1-(3-morpholin-4-ylpropyl)-5-oxo-4,4-diphenylpyrrole-3-carbonitrile Traditional Name: 5-keto-2-(methylthio)-1-(3-morpholinopropyl)-4,4-diphenyl-2-pyrroline-3-carbonitrile Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(C(=O)N1CCCN2CCOCC2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CSC1=C(C(C(=O)N1CCCN2CCOCC2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H27N3O2S/c1-31-23-22(19-26)25(20-9-4-2-5-10-20,21-11-6-3-7-12-21)24(29)28(23)14-8-13-27-15-17-30-18-16-27/h2-7,9-12H,8,13-18H2,1H3