N-[(1R)-1-(1-adamantyl)ethyl]-3,6-bis(chloranyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,6-bis(chloranyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,6-dichloro-benzothiophene-2-carboxamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,6-dichloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,6-dichloro-1-benzothiophene-2-carboxamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,6-dichloro-benzothiophene-2-carboxamide Formula: C21H23Cl2NOS MolecularWeight: 408.38442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl

InChI

InChI=1S/C21H23Cl2NOS/c1-11(21-8-12-4-13(9-21)6-14(5-12)10-21)24-20(25)19-18(23)16-3-2-15(22)7-17(16)26-19/h2-3,7,11-14H,4-6,8-10H2,1H3,(H,24,25)/t11-,12?,13?,14?,21?/m1/s1