1-(4-fluorophenyl)-3-thiophen-2-ylcarbonyl-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,2-dicarbonitrile

Systemtic Name: 1-(4-fluorophenyl)-3-thiophen-2-ylcarbonyl-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,2-dicarbonitrile Openeye Name: 1-(4-fluorophenyl)-3-(thiophene-2-carbonyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,2-dicarbonitrile CAS Name: 1-(4-fluorophenyl)-3-[oxo(thiophen-2-yl)methyl]-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,2-dicarbonitrile IUPAC Name: 1-(4-fluorophenyl)-3-(thiophene-2-carbonyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,2-dicarbonitrile Traditional Name: 1-(4-fluorophenyl)-3-(2-thenoyl)-3,10b-dihydro-2H-pyrrol[2,1-a]isoquinoline-1,2-dicarbonitrile Formula: C25H16FN3OS MolecularWeight: 425.477443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C3C(C(C(N3C=CC2=C1)C(=O)C4=CC=CS4)C#N)(C#N)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C3C(C(C(N3C=CC2=C1)C(=O)C4=CC=CS4)C#N)(C#N)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H16FN3OS/c26-18-9-7-17(8-10-18)25(15-28)20(14-27)22(23(30)21-6-3-13-31-21)29-12-11-16-4-1-2-5-19(16)24(25)29/h1-13,20,22,24H