2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)benzenecarbothioamide

Systemtic Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)benzenecarbothioamide Openeye Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)benzenecarbothioamide CAS Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)benzenecarbothioamide IUPAC Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)benzenecarbothioamide Traditional Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)thiobenzamide Formula: C17H24N2S MolecularWeight: 288.45086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2CN(CCC2C1)CC3=CC=CC=C3C(=S)N

Isomeric SMILES

C1CCC2CN(CCC2C1)CC3=CC=CC=C3C(=S)N

InChI

InChI=1S/C17H24N2S/c18-17(20)16-8-4-3-7-15(16)12-19-10-9-13-5-1-2-6-14(13)11-19/h3-4,7-8,13-14H,1-2,5-6,9-12H2,(H2,18,20)