2-(2-morpholin-4-ylethylsulfanyl)-5-oxidanylidene-4,4-diphenyl-1H-pyrrole-3-carbonitrile

Systemtic Name: 2-(2-morpholin-4-ylethylsulfanyl)-5-oxidanylidene-4,4-diphenyl-1H-pyrrole-3-carbonitrile Openeye Name: 2-(2-morpholinoethylsulfanyl)-5-oxo-4,4-diphenyl-1H-pyrrole-3-carbonitrile CAS Name: 2-[2-(4-morpholinyl)ethylthio]-5-oxo-4,4-diphenyl-1H-pyrrole-3-carbonitrile IUPAC Name: 2-(2-morpholin-4-ylethylsulfanyl)-5-oxo-4,4-diphenyl-1H-pyrrole-3-carbonitrile Traditional Name: 5-keto-2-(2-morpholinoethylthio)-4,4-diphenyl-2-pyrroline-3-carbonitrile Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCSC2=C(C(C(=O)N2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1COCCN1CCSC2=C(C(C(=O)N2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C23H23N3O2S/c24-17-20-21(29-16-13-26-11-14-28-15-12-26)25-22(27)23(20,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-10H,11-16H2,(H,25,27)