N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-1-thiophen-2-yl-cyclopentane-1-carboxamide

Systemtic Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-1-thiophen-2-yl-cyclopentane-1-carboxamide Openeye Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-1-(2-thienyl)cyclopentanecarboxamide CAS Name: N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-1-thiophen-2-yl-1-cyclopentanecarboxamide IUPAC Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-1-thiophen-2-ylcyclopentane-1-carboxamide Traditional Name: N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)-1-(2-thienyl)cyclopentanecarboxamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3(CCCC3)C4=CC=CS4

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3(CCCC3)C4=CC=CS4

InChI

InChI=1S/C22H26N2O2S/c1-2-20(25)24-12-9-16-7-8-18(14-17(16)15-24)23-21(26)22(10-3-4-11-22)19-6-5-13-27-19/h5-8,13-14H,2-4,9-12,15H2,1H3,(H,23,26)