1-(1-adamantyl)-3-(4-phenylbutyl)thiourea

Systemtic Name: 1-(1-adamantyl)-3-(4-phenylbutyl)thiourea Openeye Name: 1-(1-adamantyl)-3-(4-phenylbutyl)thiourea CAS Name: 1-(1-adamantyl)-3-(4-phenylbutyl)thiourea IUPAC Name: 1-(1-adamantyl)-3-(4-phenylbutyl)thiourea Traditional Name: 1-(1-adamantyl)-3-(4-phenylbutyl)thiourea Formula: C21H30N2S MolecularWeight: 342.5413

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=S)NCCCCC4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=S)NCCCCC4=CC=CC=C4

InChI

InChI=1S/C21H30N2S/c24-20(22-9-5-4-8-16-6-2-1-3-7-16)23-21-13-17-10-18(14-21)12-19(11-17)15-21/h1-3,6-7,17-19H,4-5,8-15H2,(H2,22,23,24)