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

Systemtic Name: (5S)-5-ethyl-N-(4-iodophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-5-ethyl-N-(4-iodophenyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-5-ethyl-N-(4-iodophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-5-ethyl-N-(4-iodophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-5-ethyl-N-(4-iodophenyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C17H18INOS MolecularWeight: 411.30039

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

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

InChI

InChI=1S/C17H18INOS/c1-2-11-3-8-15-12(9-11)10-16(21-15)17(20)19-14-6-4-13(18)5-7-14/h4-7,10-11H,2-3,8-9H2,1H3,(H,19,20)/t11-/m0/s1