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

Systemtic Name: 2-ethylsulfanyl-1-(3-morpholin-4-ylpropyl)-5-oxidanylidene-4,4-diphenyl-pyrrole-3-carbonitrile Openeye Name: 2-ethylsulfanyl-1-(3-morpholinopropyl)-5-oxo-4,4-diphenyl-pyrrole-3-carbonitrile CAS Name: 2-(ethylthio)-1-[3-(4-morpholinyl)propyl]-5-oxo-4,4-diphenyl-3-pyrrolecarbonitrile IUPAC Name: 2-ethylsulfanyl-1-(3-morpholin-4-ylpropyl)-5-oxo-4,4-diphenylpyrrole-3-carbonitrile Traditional Name: 2-(ethylthio)-5-keto-1-(3-morpholinopropyl)-4,4-diphenyl-2-pyrroline-3-carbonitrile Formula: C26H29N3O2S MolecularWeight: 447.59236

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(C(=O)N1CCCN2CCOCC2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CCSC1=C(C(C(=O)N1CCCN2CCOCC2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C26H29N3O2S/c1-2-32-24-23(20-27)26(21-10-5-3-6-11-21,22-12-7-4-8-13-22)25(30)29(24)15-9-14-28-16-18-31-19-17-28/h3-8,10-13H,2,9,14-19H2,1H3