N-(1-adamantyl)-2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-(1-adamantyl)-2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(1-adamantyl)-2-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(1-adamantyl)-2-[[2-(3-methoxyanilino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(1-adamantyl)-2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-(1-adamantyl)-2-[[2-keto-2-(m-anisidino)ethyl]thio]benzamide Formula: C26H30N2O3S MolecularWeight: 450.593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CSC2=CC=CC=C2C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CSC2=CC=CC=C2C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H30N2O3S/c1-31-21-6-4-5-20(12-21)27-24(29)16-32-23-8-3-2-7-22(23)25(30)28-26-13-17-9-18(14-26)11-19(10-17)15-26/h2-8,12,17-19H,9-11,13-16H2,1H3,(H,27,29)(H,28,30)