2-propyl-N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)pentanamide

Systemtic Name: 2-propyl-N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)pentanamide Openeye Name: 2-propyl-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]pentanamide CAS Name: N-[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-2-propylpentanamide IUPAC Name: 2-propyl-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]pentanamide Traditional Name: 2-propyl-N-[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]valeramide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NC1=CC2=C(CCN(C2)C(=O)C3=CC=CS3)C=C1

Isomeric SMILES

CCCC(CCC)C(=O)NC1=CC2=C(CCN(C2)C(=O)C3=CC=CS3)C=C1

InChI

InChI=1S/C22H28N2O2S/c1-3-6-17(7-4-2)21(25)23-19-10-9-16-11-12-24(15-18(16)14-19)22(26)20-8-5-13-27-20/h5,8-10,13-14,17H,3-4,6-7,11-12,15H2,1-2H3,(H,23,25)