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

Systemtic Name: 1-(1-adamantyl)-3-[2-(4-bromophenyl)sulfanylethyl]urea Openeye Name: 1-(1-adamantyl)-3-[2-(4-bromophenyl)sulfanylethyl]urea CAS Name: 1-(1-adamantyl)-3-[2-[(4-bromophenyl)thio]ethyl]urea IUPAC Name: 1-(1-adamantyl)-3-[2-(4-bromophenyl)sulfanylethyl]urea Traditional Name: 1-(1-adamantyl)-3-[2-[(4-bromophenyl)thio]ethyl]urea Formula: C19H25BrN2OS MolecularWeight: 409.3836

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCSC4=CC=C(C=C4)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCSC4=CC=C(C=C4)Br

InChI

InChI=1S/C19H25BrN2OS/c20-16-1-3-17(4-2-16)24-6-5-21-18(23)22-19-10-13-7-14(11-19)9-15(8-13)12-19/h1-4,13-15H,5-12H2,(H2,21,22,23)