4-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-1-thiophen-2-yl-butan-1-one

Systemtic Name: 4-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-1-thiophen-2-yl-butan-1-one Openeye Name: 4-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-1-(2-thienyl)butan-1-one CAS Name: 4-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-1-thiophen-2-yl-1-butanone IUPAC Name: 4-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-1-thiophen-2-ylbutan-1-one Traditional Name: 4-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-1-(2-thienyl)butan-1-one Formula: C17H25NOS MolecularWeight: 291.4515

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2CN(CCC2C1)CCCC(=O)C3=CC=CS3

Isomeric SMILES

C1CCC2CN(CCC2C1)CCCC(=O)C3=CC=CS3

InChI

InChI=1S/C17H25NOS/c19-16(17-8-4-12-20-17)7-3-10-18-11-9-14-5-1-2-6-15(14)13-18/h4,8,12,14-15H,1-3,5-7,9-11,13H2