1-(2-adamantyl)-3-(4-tert-butylphenyl)thiourea

Systemtic Name: 1-(2-adamantyl)-3-(4-tert-butylphenyl)thiourea Openeye Name: 1-(2-adamantyl)-3-(4-tert-butylphenyl)thiourea CAS Name: 1-(2-adamantyl)-3-(4-tert-butylphenyl)thiourea IUPAC Name: 1-(2-adamantyl)-3-(4-tert-butylphenyl)thiourea Traditional Name: 1-(2-adamantyl)-3-(4-tert-butylphenyl)thiourea Formula: C21H30N2S MolecularWeight: 342.5413

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=S)NC2C3CC4CC(C3)CC2C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=S)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C21H30N2S/c1-21(2,3)17-4-6-18(7-5-17)22-20(24)23-19-15-9-13-8-14(11-15)12-16(19)10-13/h4-7,13-16,19H,8-12H2,1-3H3,(H2,22,23,24)