N-[1-(1-adamantyl)ethyl]-3-chloranyl-6-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-3-chloranyl-6-methyl-1-benzothiophene-2-carboxamide Openeye Name: N-[1-(1-adamantyl)ethyl]-3-chloro-6-methyl-benzothiophene-2-carboxamide CAS Name: N-[1-(1-adamantyl)ethyl]-3-chloro-6-methyl-1-benzothiophene-2-carboxamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-3-chloro-6-methyl-1-benzothiophene-2-carboxamide Traditional Name: N-[1-(1-adamantyl)ethyl]-3-chloro-6-methyl-benzothiophene-2-carboxamide Formula: C22H26ClNOS MolecularWeight: 387.96594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(C)C34CC5CC(C3)CC(C5)C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(C)C34CC5CC(C3)CC(C5)C4)Cl

InChI

InChI=1S/C22H26ClNOS/c1-12-3-4-17-18(5-12)26-20(19(17)23)21(25)24-13(2)22-9-14-6-15(10-22)8-16(7-14)11-22/h3-5,13-16H,6-11H2,1-2H3,(H,24,25)