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

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

Systemtic Name:1-[1-(1-adamantyl)butyl]-3-(4-butylphenyl)thiourea
Openeye Name:1-[1-(1-adamantyl)butyl]-3-(4-butylphenyl)thiourea
CAS Name:1-[1-(1-adamantyl)butyl]-3-(4-butylphenyl)thiourea
IUPAC Name:1-[1-(1-adamantyl)butyl]-3-(4-butylphenyl)thiourea
Traditional Name:1-[1-(1-adamantyl)butyl]-3-(4-butylphenyl)thiourea
Formula: C25H38N2S
MolecularWeight: 398.64762
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C25H38N2S/c1-3-5-7-18-8-10-22(11-9-18)26-24(28)27-23(6-4-2)25-15-19-12-20(16-25)14-21(13-19)17-25/h8-11,19-21,23H,3-7,12-17H2,1-2H3,(H2,26,27,28)


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