N-[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[2-(3-chlorophenyl)-2-hydroxy-ethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[2-(3-chlorophenyl)-2-hydroxyethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[2-(3-chlorophenyl)-2-hydroxyethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[2-(3-chlorophenyl)-2-hydroxy-ethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C17H18ClNO2S MolecularWeight: 335.84832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NCC(C3=CC(=CC=C3)Cl)O

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NCC(C3=CC(=CC=C3)Cl)O

InChI

InChI=1S/C17H18ClNO2S/c18-12-5-3-4-11(8-12)15(20)9-19-17(21)14-10-22-16-7-2-1-6-13(14)16/h3-5,8,10,15,20H,1-2,6-7,9H2,(H,19,21)