1-(2-methylpropyl)-3-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethanoyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-(2-methylpropyl)-3-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethanoyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-isobutyl-3-[4-(2-oxo-2-pyrrolidin-1-yl-acetyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 3-[4-[1,2-dioxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-(2-methylpropyl)-3-[4-(2-oxo-2-pyrrolidin-1-ylacetyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-isobutyl-3-[4-(2-keto-2-pyrrolidino-acetyl)piperazino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C24H33N5O2 MolecularWeight: 423.55112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C2CCCCC2=C(C(=N1)N3CCN(CC3)C(=O)C(=O)N4CCCC4)C#N

Isomeric SMILES

CC(C)CC1=C2CCCCC2=C(C(=N1)N3CCN(CC3)C(=O)C(=O)N4CCCC4)C#N

InChI

InChI=1S/C24H33N5O2/c1-17(2)15-21-19-8-4-3-7-18(19)20(16-25)22(26-21)27-11-13-29(14-12-27)24(31)23(30)28-9-5-6-10-28/h17H,3-15H2,1-2H3