1-(2-adamantyl)-3-[(4-chlorophenyl)methyl]thiourea

Systemtic Name: 1-(2-adamantyl)-3-[(4-chlorophenyl)methyl]thiourea Openeye Name: 1-(2-adamantyl)-3-[(4-chlorophenyl)methyl]thiourea CAS Name: 1-(2-adamantyl)-3-[(4-chlorophenyl)methyl]thiourea IUPAC Name: 1-(2-adamantyl)-3-[(4-chlorophenyl)methyl]thiourea Traditional Name: 1-(2-adamantyl)-3-(4-chlorobenzyl)thiourea Formula: C18H23ClN2S MolecularWeight: 334.90662

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=S)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=S)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H23ClN2S/c19-16-3-1-11(2-4-16)10-20-18(22)21-17-14-6-12-5-13(8-14)9-15(17)7-12/h1-4,12-15,17H,5-10H2,(H2,20,21,22)