2-butylsulfanyl-5-oxidanylidene-4,4-diphenyl-1H-pyrrole-3-carbonitrile

Systemtic Name: 2-butylsulfanyl-5-oxidanylidene-4,4-diphenyl-1H-pyrrole-3-carbonitrile Openeye Name: 2-butylsulfanyl-5-oxo-4,4-diphenyl-1H-pyrrole-3-carbonitrile CAS Name: 2-(butylthio)-5-oxo-4,4-diphenyl-1H-pyrrole-3-carbonitrile IUPAC Name: 2-butylsulfanyl-5-oxo-4,4-diphenyl-1H-pyrrole-3-carbonitrile Traditional Name: 2-(butylthio)-5-keto-4,4-diphenyl-2-pyrroline-3-carbonitrile Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2OS/c1-2-3-14-25-19-18(15-22)21(20(24)23-19,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,2-3,14H2,1H3,(H,23,24)