1-(1-adamantyl)-3-[2-(4-methylphenyl)sulfanylethyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[2-(4-methylphenyl)sulfanylethyl]urea Openeye Name: 1-(1-adamantyl)-3-[2-(p-tolylsulfanyl)ethyl]urea CAS Name: 1-(1-adamantyl)-3-[2-[(4-methylphenyl)thio]ethyl]urea IUPAC Name: 1-(1-adamantyl)-3-[2-(4-methylphenyl)sulfanylethyl]urea Traditional Name: 1-(1-adamantyl)-3-[2-(p-tolylthio)ethyl]urea Formula: C20H28N2OS MolecularWeight: 344.51412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H28N2OS/c1-14-2-4-18(5-3-14)24-7-6-21-19(23)22-20-11-15-8-16(12-20)10-17(9-15)13-20/h2-5,15-17H,6-13H2,1H3,(H2,21,22,23)