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1-[(1S)-1-(1-adamantyl)butyl]-3-[(4-fluorophenyl)methyl]thiourea

1-[(1S)-1-(1-adamantyl)butyl]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name:1-[(1S)-1-(1-adamantyl)butyl]-3-[(4-fluorophenyl)methyl]thiourea
Openeye Name:1-[(1S)-1-(1-adamantyl)butyl]-3-[(4-fluorophenyl)methyl]thiourea
CAS Name:1-[(1S)-1-(1-adamantyl)butyl]-3-[(4-fluorophenyl)methyl]thiourea
IUPAC Name:1-[(1S)-1-(1-adamantyl)butyl]-3-[(4-fluorophenyl)methyl]thiourea
Traditional Name:1-[(1S)-1-(1-adamantyl)butyl]-3-(4-fluorobenzyl)thiourea
Formula: C22H31FN2S
MolecularWeight: 374.558343
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C12CC3CC(C1)CC(C3)C2)NC(=S)NCC4=CC=C(C=C4)F


Isomeric SMILES

CCC[C@@H](C12CC3CC(C1)CC(C3)C2)NC(=S)NCC4=CC=C(C=C4)F


InChI

InChI=1S/C22H31FN2S/c1-2-3-20(22-11-16-8-17(12-22)10-18(9-16)13-22)25-21(26)24-14-15-4-6-19(23)7-5-15/h4-7,16-18,20H,2-3,8-14H2,1H3,(H2,24,25,26)/t16?,17?,18?,20-,22?/m0/s1


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