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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC[C@H]1CCC2=C(C1)C=C(S2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H19NO3S/c1-2-11-3-6-16-12(7-11)8-17(23-16)18(20)19-13-4-5-14-15(9-13)22-10-21-14/h4-5,8-9,11H,2-3,6-7,10H2,1H3,(H,19,20)/t11-/m0/s1