2-[4-(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-N-(3-methoxypropyl)-2-oxidanylidene-ethanamide

Systemtic Name: 2-[4-(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-N-(3-methoxypropyl)-2-oxidanylidene-ethanamide Openeye Name: 2-[4-(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-N-(3-methoxypropyl)-2-oxo-acetamide CAS Name: 2-[4-(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)-1-piperazinyl]-N-(3-methoxypropyl)-2-oxoacetamide IUPAC Name: 2-[4-(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-N-(3-methoxypropyl)-2-oxoacetamide Traditional Name: 2-[4-(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazino]-2-keto-N-(3-methoxypropyl)acetamide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N5O3/c1-15-16-6-3-4-7-17(16)18(14-22)19(24-15)25-9-11-26(12-10-25)21(28)20(27)23-8-5-13-29-2/h3-13H2,1-2H3,(H,23,27)