N-(1-adamantyl)-4-[(4-chlorophenyl)sulfanylmethyl]-N-ethyl-benzamide

Systemtic Name: N-(1-adamantyl)-4-[(4-chlorophenyl)sulfanylmethyl]-N-ethyl-benzamide Openeye Name: N-(1-adamantyl)-4-[(4-chlorophenyl)sulfanylmethyl]-N-ethyl-benzamide CAS Name: N-(1-adamantyl)-4-[[(4-chlorophenyl)thio]methyl]-N-ethylbenzamide IUPAC Name: N-(1-adamantyl)-4-[(4-chlorophenyl)sulfanylmethyl]-N-ethylbenzamide Traditional Name: N-(1-adamantyl)-4-[[(4-chlorophenyl)thio]methyl]-N-ethyl-benzamide Formula: C26H30ClNOS MolecularWeight: 440.0405

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C1=CC=C(C=C1)CSC2=CC=C(C=C2)Cl)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN(C(=O)C1=CC=C(C=C1)CSC2=CC=C(C=C2)Cl)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H30ClNOS/c1-2-28(26-14-19-11-20(15-26)13-21(12-19)16-26)25(29)22-5-3-18(4-6-22)17-30-24-9-7-23(27)8-10-24/h3-10,19-21H,2,11-17H2,1H3