1-(1-adamantyl)-3-(3-chlorophenyl)sulfanyl-urea

Systemtic Name: 1-(1-adamantyl)-3-(3-chlorophenyl)sulfanyl-urea Openeye Name: 1-(1-adamantyl)-3-(3-chlorophenyl)sulfanyl-urea CAS Name: 1-(1-adamantyl)-3-[(3-chlorophenyl)thio]urea IUPAC Name: 1-(1-adamantyl)-3-(3-chlorophenyl)sulfanylurea Traditional Name: 1-(1-adamantyl)-3-[(3-chlorophenyl)thio]urea Formula: C17H21ClN2OS MolecularWeight: 336.87944

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NSC4=CC(=CC=C4)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NSC4=CC(=CC=C4)Cl

InChI

InChI=1S/C17H21ClN2OS/c18-14-2-1-3-15(7-14)22-20-16(21)19-17-8-11-4-12(9-17)6-13(5-11)10-17/h1-3,7,11-13H,4-6,8-10H2,(H2,19,20,21)