3-chloranyl-N-[(2S)-3-(4-methoxyphenoxy)-2-oxidanyl-propyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(2S)-3-(4-methoxyphenoxy)-2-oxidanyl-propyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(2S)-2-hydroxy-3-(4-methoxyphenoxy)propyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(2S)-2-hydroxy-3-(4-methoxyphenoxy)propyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(2S)-2-hydroxy-3-(4-methoxyphenoxy)propyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(2S)-2-hydroxy-3-(4-methoxyphenoxy)propyl]benzothiophene-2-carboxamide Formula: C19H18ClNO4S MolecularWeight: 391.86852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)O

Isomeric SMILES

COC1=CC=C(C=C1)OC[C@H](CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)O

InChI

InChI=1S/C19H18ClNO4S/c1-24-13-6-8-14(9-7-13)25-11-12(22)10-21-19(23)18-17(20)15-4-2-3-5-16(15)26-18/h2-9,12,22H,10-11H2,1H3,(H,21,23)/t12-/m0/s1