1-(1-adamantyl)-3-[3,5-bis(chloranyl)phenyl]-1-methyl-thiourea

Systemtic Name: 1-(1-adamantyl)-3-[3,5-bis(chloranyl)phenyl]-1-methyl-thiourea Openeye Name: 1-(1-adamantyl)-3-(3,5-dichlorophenyl)-1-methyl-thiourea CAS Name: 1-(1-adamantyl)-3-(3,5-dichlorophenyl)-1-methylthiourea IUPAC Name: 1-(1-adamantyl)-3-(3,5-dichlorophenyl)-1-methylthiourea Traditional Name: 1-(1-adamantyl)-3-(3,5-dichlorophenyl)-1-methyl-thiourea Formula: C18H22Cl2N2S MolecularWeight: 369.35168

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NC1=CC(=CC(=C1)Cl)Cl)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C(=S)NC1=CC(=CC(=C1)Cl)Cl)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H22Cl2N2S/c1-22(17(23)21-16-6-14(19)5-15(20)7-16)18-8-11-2-12(9-18)4-13(3-11)10-18/h5-7,11-13H,2-4,8-10H2,1H3,(H,21,23)