1-[1-(1-adamantyl)ethyl]-3-(4-butylphenyl)thiourea

Systemtic Name: 1-[1-(1-adamantyl)ethyl]-3-(4-butylphenyl)thiourea Openeye Name: 1-[1-(1-adamantyl)ethyl]-3-(4-butylphenyl)thiourea CAS Name: 1-[1-(1-adamantyl)ethyl]-3-(4-butylphenyl)thiourea IUPAC Name: 1-[1-(1-adamantyl)ethyl]-3-(4-butylphenyl)thiourea Traditional Name: 1-[1-(1-adamantyl)ethyl]-3-(4-butylphenyl)thiourea Formula: C23H34N2S MolecularWeight: 370.59446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC(C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC(C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H34N2S/c1-3-4-5-17-6-8-21(9-7-17)25-22(26)24-16(2)23-13-18-10-19(14-23)12-20(11-18)15-23/h6-9,16,18-20H,3-5,10-15H2,1-2H3,(H2,24,25,26)