1-[3-(2,2-dimethylpyrrolidin-1-yl)carbonyl-8-methoxy-1-thiophen-2-yl-5,6-dihydropyrrolo[2,1-a]isoquinolin-9-yl]ethanone

Systemtic Name: 1-[3-(2,2-dimethylpyrrolidin-1-yl)carbonyl-8-methoxy-1-thiophen-2-yl-5,6-dihydropyrrolo[2,1-a]isoquinolin-9-yl]ethanone Openeye Name: 1-[3-(2,2-dimethylpyrrolidine-1-carbonyl)-8-methoxy-1-(2-thienyl)-5,6-dihydropyrrolo[2,1-a]isoquinolin-9-yl]ethanone CAS Name: 1-[3-[(2,2-dimethyl-1-pyrrolidinyl)-oxomethyl]-8-methoxy-1-thiophen-2-yl-5,6-dihydropyrrolo[2,1-a]isoquinolin-9-yl]ethanone IUPAC Name: 1-[3-(2,2-dimethylpyrrolidine-1-carbonyl)-8-methoxy-1-thiophen-2-yl-5,6-dihydropyrrolo[2,1-a]isoquinolin-9-yl]ethanone Traditional Name: 1-[3-(2,2-dimethylpyrrolidine-1-carbonyl)-8-methoxy-1-(2-thienyl)-5,6-dihydropyrrol[2,1-a]isoquinolin-9-yl]ethanone Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C2CCN3C(=CC(=C3C2=C1)C4=CC=CS4)C(=O)N5CCCC5(C)C)OC

Isomeric SMILES

CC(=O)C1=C(C=C2CCN3C(=CC(=C3C2=C1)C4=CC=CS4)C(=O)N5CCCC5(C)C)OC

InChI

InChI=1S/C26H28N2O3S/c1-16(29)18-14-19-17(13-22(18)31-4)8-11-27-21(25(30)28-10-6-9-26(28,2)3)15-20(24(19)27)23-7-5-12-32-23/h5,7,12-15H,6,8-11H2,1-4H3