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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2CCCCC2=C(C(=N1)N3CCN(CC3)C(=O)C(=O)NCCO)C#N

Isomeric SMILES

CC(C)C1=C2CCCCC2=C(C(=N1)N3CCN(CC3)C(=O)C(=O)NCCO)C#N

InChI

InChI=1S/C21H29N5O3/c1-14(2)18-16-6-4-3-5-15(16)17(13-22)19(24-18)25-8-10-26(11-9-25)21(29)20(28)23-7-12-27/h14,27H,3-12H2,1-2H3,(H,23,28)