N-[2-(1-adamantylcarbamoyl)phenyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(1-adamantylcarbamoyl)phenyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(1-adamantylcarbamoyl)phenyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[2-[(1-adamantylamino)-oxomethyl]phenyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(1-adamantylcarbamoyl)phenyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(1-adamantylcarbamoyl)phenyl]-3-chloro-benzothiophene-2-carboxamide Formula: C26H25ClN2O2S MolecularWeight: 465.0069

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC=CC=C4NC(=O)C5=C(C6=CC=CC=C6S5)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC=CC=C4NC(=O)C5=C(C6=CC=CC=C6S5)Cl

InChI

InChI=1S/C26H25ClN2O2S/c27-22-19-6-2-4-8-21(19)32-23(22)25(31)28-20-7-3-1-5-18(20)24(30)29-26-12-15-9-16(13-26)11-17(10-15)14-26/h1-8,15-17H,9-14H2,(H,28,31)(H,29,30)