8,9-dimethoxy-2-(4-methylphenyl)-3-thiophen-2-ylcarbonyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carbonitrile

Systemtic Name: 8,9-dimethoxy-2-(4-methylphenyl)-3-thiophen-2-ylcarbonyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carbonitrile Openeye Name: 8,9-dimethoxy-2-(p-tolyl)-3-(thiophene-2-carbonyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carbonitrile CAS Name: 8,9-dimethoxy-2-(4-methylphenyl)-3-[oxo(thiophen-2-yl)methyl]-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carbonitrile IUPAC Name: 8,9-dimethoxy-2-(4-methylphenyl)-3-(thiophene-2-carbonyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carbonitrile Traditional Name: 8,9-dimethoxy-2-(p-tolyl)-3-(2-thenoyl)-5,6-dihydropyrrol[2,1-a]isoquinoline-1-carbonitrile Formula: C27H22N2O3S MolecularWeight: 454.54018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N3CCC4=CC(=C(C=C4C3=C2C#N)OC)OC)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N3CCC4=CC(=C(C=C4C3=C2C#N)OC)OC)C(=O)C5=CC=CS5

InChI

InChI=1S/C27H22N2O3S/c1-16-6-8-17(9-7-16)24-20(15-28)25-19-14-22(32-3)21(31-2)13-18(19)10-11-29(25)26(24)27(30)23-5-4-12-33-23/h4-9,12-14H,10-11H2,1-3H3