5-[2-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl-methyl-amino]ethyl]-1,3-benzodithiol-2-one

Systemtic Name: 5-[2-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl-methyl-amino]ethyl]-1,3-benzodithiol-2-one Openeye Name: 5-[2-[(5-methoxytetralin-1-yl)methyl-methyl-amino]ethyl]-1,3-benzodithiol-2-one CAS Name: 5-[2-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl-methylamino]ethyl]-1,3-benzodithiol-2-one IUPAC Name: 5-[2-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl-methylamino]ethyl]-1,3-benzodithiol-2-one Traditional Name: 5-[2-[(5-methoxytetralin-1-yl)methyl-methyl-amino]ethyl]-1,3-benzodithiol-2-one Formula: C22H25NO2S2 MolecularWeight: 399.5694

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC2=C(C=C1)SC(=O)S2)CC3CCCC4=C3C=CC=C4OC

Isomeric SMILES

CN(CCC1=CC2=C(C=C1)SC(=O)S2)CC3CCCC4=C3C=CC=C4OC

InChI

InChI=1S/C22H25NO2S2/c1-23(12-11-15-9-10-20-21(13-15)27-22(24)26-20)14-16-5-3-7-18-17(16)6-4-8-19(18)25-2/h4,6,8-10,13,16H,3,5,7,11-12,14H2,1-2H3