N-[(2R)-2-(1-adamantyloxy)propyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(2R)-2-(1-adamantyloxy)propyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[(2R)-2-(1-adamantyloxy)propyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[(2R)-2-(1-adamantyloxy)propyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(2R)-2-(1-adamantyloxy)propyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[(2R)-2-(1-adamantyloxy)propyl]-3-chloro-benzothiophene-2-carboxamide Formula: C22H26ClNO2S MolecularWeight: 403.96534

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=C(C2=CC=CC=C2S1)Cl)OC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@H](CNC(=O)C1=C(C2=CC=CC=C2S1)Cl)OC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H26ClNO2S/c1-13(26-22-9-14-6-15(10-22)8-16(7-14)11-22)12-24-21(25)20-19(23)17-4-2-3-5-18(17)27-20/h2-5,13-16H,6-12H2,1H3,(H,24,25)/t13-,14?,15?,16?,22?/m1/s1