1-(2-diethylaminoethyl)-5-oxidanylidene-4,4-diphenyl-2-propylsulfanyl-pyrrole-3-carbonitrile

Systemtic Name: 1-(2-diethylaminoethyl)-5-oxidanylidene-4,4-diphenyl-2-propylsulfanyl-pyrrole-3-carbonitrile Openeye Name: 1-(2-diethylaminoethyl)-5-oxo-4,4-diphenyl-2-propylsulfanyl-pyrrole-3-carbonitrile CAS Name: 1-(2-diethylaminoethyl)-5-oxo-4,4-diphenyl-2-(propylthio)-3-pyrrolecarbonitrile IUPAC Name: 1-(2-diethylaminoethyl)-5-oxo-4,4-diphenyl-2-propylsulfanylpyrrole-3-carbonitrile Traditional Name: 1-(2-diethylaminoethyl)-5-keto-4,4-diphenyl-2-(propylthio)-2-pyrroline-3-carbonitrile Formula: C26H31N3OS MolecularWeight: 433.60884

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C(C(=O)N1CCN(CC)CC)(C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCSC1=C(C(C(=O)N1CCN(CC)CC)(C2=CC=CC=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C26H31N3OS/c1-4-19-31-24-23(20-27)26(21-13-9-7-10-14-21,22-15-11-8-12-16-22)25(30)29(24)18-17-28(5-2)6-3/h7-16H,4-6,17-19H2,1-3H3