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

Systemtic Name: 1-(2-diethylaminoethyl)-5-oxidanylidene-4,4-diphenyl-2-propan-2-ylsulfanyl-pyrrole-3-carbonitrile Openeye Name: 1-(2-diethylaminoethyl)-2-isopropylsulfanyl-5-oxo-4,4-diphenyl-pyrrole-3-carbonitrile CAS Name: 1-(2-diethylaminoethyl)-5-oxo-4,4-diphenyl-2-(propan-2-ylthio)-3-pyrrolecarbonitrile IUPAC Name: 1-(2-diethylaminoethyl)-5-oxo-4,4-diphenyl-2-propan-2-ylsulfanylpyrrole-3-carbonitrile Traditional Name: 1-(2-diethylaminoethyl)-2-(isopropylthio)-5-keto-4,4-diphenyl-2-pyrroline-3-carbonitrile Formula: C26H31N3OS MolecularWeight: 433.60884

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(=C(C(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3)C#N)SC(C)C

Isomeric SMILES

CCN(CC)CCN1C(=C(C(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3)C#N)SC(C)C

InChI

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