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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2C3CC4CC(C3)CC2C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C21H30N2S/c1-2-3-4-14-5-7-19(8-6-14)22-21(24)23-20-17-10-15-9-16(12-17)13-18(20)11-15/h5-8,15-18,20H,2-4,9-13H2,1H3,(H2,22,23,24)