N-[2-(1-adamantyl)ethyl]-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-[2-(1-adamantyl)ethyl]-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-[2-(1-adamantyl)ethyl]-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-[2-(1-adamantyl)ethyl]-2-[[2-(4-methylanilino)-2-oxoethyl]thio]benzamide IUPAC Name: N-[2-(1-adamantyl)ethyl]-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-[2-(1-adamantyl)ethyl]-2-[[2-keto-2-(p-toluidino)ethyl]thio]benzamide Formula: C28H34N2O2S MolecularWeight: 462.64676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)NCCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)NCCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H34N2O2S/c1-19-6-8-23(9-7-19)30-26(31)18-33-25-5-3-2-4-24(25)27(32)29-11-10-28-15-20-12-21(16-28)14-22(13-20)17-28/h2-9,20-22H,10-18H2,1H3,(H,29,32)(H,30,31)