N-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]methyl]-3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanamide

Systemtic Name: N-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]methyl]-3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanamide Openeye Name: N-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridyl]methyl]-3-(2-oxothiazolidin-3-yl)propanamide CAS Name: N-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridinyl]methyl]-3-(2-oxo-3-thiazolidinyl)propanamide IUPAC Name: N-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]methyl]-3-(2-oxo-1,3-thiazolidin-3-yl)propanamide Traditional Name: N-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridyl]methyl]-3-(2-ketothiazolidin-3-yl)propionamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=NC=C(C=C3)CNC(=O)CCN4CCSC4=O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=NC=C(C=C3)CNC(=O)CCN4CCSC4=O

InChI

InChI=1S/C21H24N4O2S/c26-20(8-10-24-11-12-28-21(24)27)23-14-16-5-6-19(22-13-16)25-9-7-17-3-1-2-4-18(17)15-25/h1-6,13H,7-12,14-15H2,(H,23,26)