N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyrrolidin-1-ylcarbonyl-phenyl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyrrolidin-1-ylcarbonyl-phenyl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-2-(2-thienyl)acetamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[oxo(1-pyrrolidinyl)methyl]phenyl]-2-thiophen-2-ylacetamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-2-thiophen-2-ylacetamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-2-(2-thienyl)acetamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)CC3=CC=CS3)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)CC3=CC=CS3)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C26H27N3O2S/c30-25(17-22-8-5-15-32-22)27-21-9-10-24(23(16-21)26(31)28-12-3-4-13-28)29-14-11-19-6-1-2-7-20(19)18-29/h1-2,5-10,15-16H,3-4,11-14,17-18H2,(H,27,30)