(5S)-N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: (5S)-N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-5-methyl-N-piperonyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C18H19NO3S MolecularWeight: 329.41336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H19NO3S/c1-11-2-5-16-13(6-11)8-17(23-16)18(20)19-9-12-3-4-14-15(7-12)22-10-21-14/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H,19,20)/t11-/m0/s1