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

Systemtic Name: 3-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)benzenecarbothioamide Openeye Name: 3-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)benzenecarbothioamide CAS Name: 3-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)benzenecarbothioamide IUPAC Name: 3-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)benzenecarbothioamide Traditional Name: 3-(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(=C3)C(=S)N

Isomeric SMILES

C1CCC2CN(CCC2C1)CC3=CC=CC(=C3)C(=S)N

InChI

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